1,3,4-oxadiazoles

Alfa Aesar™ 2,5-Diphenyl-1,3,4-oxadiazole, 97%

CAS: 725-12-2 Molecular Formula: C14H10N2O Molecular Weight (g/mol): 222.247 MDL Number: MFCD00003102 InChI Key: DCJKUXYSYJBBRD-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2,5-diphenyl PubChem CID: 12888 IUPAC Name: 2,5-diphenyl-1,3,4-oxadiazole SMILES: C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3

Alfa Aesar™ 5-Phenyl-1,3,4-oxadiazole-2-thiol, 98%

CAS: 3004-42-0 Molecular Formula: C8H6N2OS Molecular Weight (g/mol): 178.209 MDL Number: MFCD00030467 InChI Key: FOHWXVBZGSVUGO-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole-2 3h-thione, 5-phenyl PubChem CID: 735254 IUPAC Name: 5-phenyl-3H-1,3,4-oxadiazole-2-thione SMILES: C1=CC=C(C=C1)C2=NNC(=S)O2

Alfa Aesar™ 5-(4-Pyridyl)-1,3,4-oxadiazole-2-thiol, 97%

CAS: 15264-63-8 Molecular Formula: C7H5N3OS Molecular Weight (g/mol): 179.197 MDL Number: MFCD00215200 InChI Key: TXCXZVFDWQYTIC-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole-2 3h-thione,5-4-pyridinyl PubChem CID: 774383 IUPAC Name: 5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione SMILES: C1=CN=CC=C1C2=NNC(=S)O2

Alfa Aesar™ 2-(4-Bromophenyl)-5-(1-naphthyl)-1,3,4-oxadiazole, 99%

CAS: 68047-37-0 Molecular Formula: C18H11BrN2O Molecular Weight (g/mol): 351.203 MDL Number: MFCD00050980 InChI Key: VZEIYIPOCFGTPV-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2-4-bromophenyl-5-1-naphthalenyl PubChem CID: 631794 IUPAC Name: 2-(4-bromophenyl)-5-naphthalen-1-yl-1,3,4-oxadiazole SMILES: C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)C4=CC=C(C=C4)Br

2-Chloromethyl-5-(4-methoxyphenyl)-1,3,4-oxadiazole, 98%, ACROS Organics™

CAS: 24023-71-0 Molecular Formula: C10H9ClN2O2 Molecular Weight (g/mol): 224.65 MDL Number: MFCD01230030 InChI Key: GEHIXSKXGCIKJJ-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2-chloromethyl-5-4-methoxyphenyl PubChem CID: 2734194 IUPAC Name: 2-(chloromethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole SMILES: COC1=CC=C(C=C1)C2=NN=C(O2)CCl

Alfa Aesar™ 2,5-Bis(1-naphthyl)-1,3,4-oxadiazole, 99%

CAS: 905-62-4 Molecular Formula: C22H14N2O Molecular Weight (g/mol): 322.367 MDL Number: MFCD00045582 InChI Key: MUNFOTHAFHGRIM-UHFFFAOYSA-N Synonym: 2,5-bis 1-naphthyl-1,3,4-oxadiazole PubChem CID: 70182 IUPAC Name: 2,5-dinaphthalen-1-yl-1,3,4-oxadiazole SMILES: C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)C4=CC=CC5=CC=CC=C54

Alfa Aesar™ 2,5-Bis(4-nitrophenyl)-1,3,4-oxadiazole, 97%

CAS: 1044-49-1 Molecular Formula: C14H8N4O5 Molecular Weight (g/mol): 312.241 MDL Number: MFCD00173659 InChI Key: NXVIYWNQRSLRGX-UHFFFAOYSA-N Synonym: 0-27-00-00592 beilstein handbook reference PubChem CID: 13971 IUPAC Name: 2,5-bis(4-nitrophenyl)-1,3,4-oxadiazole SMILES: C1=CC(=CC=C1C2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Alfa Aesar™ 2,5-Bis(4-biphenylyl)-1,3,4-oxadiazole, 99%

CAS: 2043-06-3 Molecular Formula: C26H18N2O Molecular Weight (g/mol): 374.44 MDL Number: MFCD00042666 InChI Key: IVVYVRLKDGGUEL-UHFFFAOYSA-N Synonym: 2,5-bis 1,1'-biphenyl-4-yl-1,3,4-oxadiazole PubChem CID: 96840 IUPAC Name: 2,5-bis(4-phenylphenyl)-1,3,4-oxadiazole SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(O3)C4=CC=C(C=C4)C5=CC=CC=C5

2-(Chloromethyl)-5-phenyl-1,3,4-oxadiazole, 97%, ACROS Organics™

CAS: 33575-83-6 Molecular Formula: C9H7ClN2O Molecular Weight (g/mol): 194.618 InChI Key: AGLNTFQAHIRTFA-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2-chloromethyl-5-phenyl PubChem CID: 314941 IUPAC Name: 2-(chloromethyl)-5-phenyl-1,3,4-oxadiazole SMILES: C1=CC=C(C=C1)C2=NN=C(O2)CCl

Alfa Aesar™ 5-(o-Tolyl)-1,3,4-oxadiazole-2-thiol, 96%

CAS: 2503-66-4 Molecular Formula: C9H8N2OS Molecular Weight (g/mol): 192.236 MDL Number: MFCD00992514 InChI Key: HNFIJWNVPWXSOL-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole-2 3h-thione,5-2-methylphenyl PubChem CID: 774385 IUPAC Name: 5-(2-methylphenyl)-3H-1,3,4-oxadiazole-2-thione SMILES: CC1=CC=CC=C1C2=NNC(=S)O2

Raltegravir potassium salt, Acros Organics™

CAS: 871038-72-1 Molecular Formula: C20H20FKN6O5 Molecular Weight (g/mol): 482.514 InChI Key: IFUKBHBISRAZTF-UHFFFAOYSA-M Synonym: isentress tn PubChem CID: 23668479 IUPAC Name: potassium;4-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-2-[2-[(5-methyl-1,3,4-oxadiazole-2-carbonyl)amino]propan-2-yl]-6-oxopyrimidin-5-olate SMILES: CC1=NN=C(O1)C(=O)NC(C)(C)C2=NC(=C(C(=O)N2C)[O-])C(=O)NCC3=CC=C(C=C3)F.[K+]

2-[4-(1,3,4-Oxadiazol-2-yl)phenoxy]acetamidoxime, 97%, Alfa Aesar™

CAS: 258521-20-9 Molecular Formula: C10H10N4O3 Molecular Weight (g/mol): 234.215 MDL Number: MFCD01764763 InChI Key: RNDSGEINHPCNQK-UHFFFAOYSA-N Synonym: 1-hydroxyimino-2-4-1,3,4-oxadiazol-2-yl phenoxy ethylamine PubChem CID: 57376339 IUPAC Name: N'-hydroxy-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanimidamide SMILES: C1=CC(=CC=C1C2=NN=CO2)OCC(=NO)N

Alfa Aesar™ 4-(5-Methyl-1,3,4-oxadiazol-2-yl)benzeneboronic acid, 98%

CAS: 913835-70-8 Molecular Formula: C9H9BN2O3 Molecular Weight (g/mol): 203.992 MDL Number: MFCD08436062 InChI Key: SPSKFVHUUJWUPB-UHFFFAOYSA-N Synonym: 2-4-boronophenyl-5-methyl-1,3,4-oxadiazole PubChem CID: 44119343 IUPAC Name: [4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)C2=NN=C(O2)C)(O)O

Potassium 5-Methyl-1,3,4-oxadiazole-2-carboxylate 98.0+%, TCI America™

CAS: 888504-28-7 Molecular Formula: C4H3KN2O3 Molecular Weight (g/mol): 166.177 MDL Number: MFCD08060085 InChI Key: BRHMYHXNUGVBCU-UHFFFAOYSA-M Synonym: 5-Methyl-1,3,4-oxadiazole-2-carboxylic Acid Potassium Salt PubChem CID: 24820502 IUPAC Name: potassium;5-methyl-1,3,4-oxadiazole-2-carboxylate SMILES: CC1=NN=C(O1)C(=O)[O-].[K+]

2-Amino-5-phenyl-1,3,4-oxadiazole 97.0+%, TCI America™

CAS: 1612-76-6 Molecular Formula: C8H7N3O Molecular Weight (g/mol): 161.164 MDL Number: MFCD00126383 InChI Key: CQSFYCBGVMWPCM-UHFFFAOYSA-N PubChem CID: 15363 IUPAC Name: 5-phenyl-1,3,4-oxadiazol-2-amine SMILES: C1=CC=C(C=C1)C2=NN=C(O2)N

Oxadiazon, SPEX CertiPrep™

CAS: 19666-30-9 Molecular Formula: C15H18Cl2N2O3 Molecular Weight (g/mol): 345.22 InChI Key: CHNUNORXWHYHNE-UHFFFAOYSA-N PubChem CID: 29732 ChEBI: CHEBI:81786 IUPAC Name: 5-tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one SMILES: CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl

2,5-Di(1-naphthyl)-1,3,4-oxadiazole 98.0+%, TCI America™

CAS: 905-62-4 Molecular Formula: C22H14N2O Molecular Weight (g/mol): 322.367 MDL Number: MFCD00045582 InChI Key: MUNFOTHAFHGRIM-UHFFFAOYSA-N Synonym: 2,5-bis 1-naphthyl-1,3,4-oxadiazole PubChem CID: 70182 IUPAC Name: 2,5-dinaphthalen-1-yl-1,3,4-oxadiazole SMILES: C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)C4=CC=CC5=CC=CC=C54

2-(4-tert-Butylphenyl)-5-(4-biphenylyl)-1,3,4-oxadiazole (purified by sublimation) 99.0+%, TCI America™

CAS: 15082-28-7 Molecular Formula: C24H22N2O Molecular Weight (g/mol): 354.453 MDL Number: MFCD00003101 InChI Key: XZCJVWCMJYNSQO-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2-1,1'-biphenyl-4-yl-5-4-1,1-dimethylethyl phenyl PubChem CID: 84782 IUPAC Name: 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4

2-(4-tert-Butylphenyl)-5-(4-biphenylyl)-1,3,4-oxadiazole 98.0+%, TCI America™

CAS: 15082-28-7 Molecular Formula: C24H22N2O Molecular Weight (g/mol): 354.453 MDL Number: MFCD00003101 InChI Key: XZCJVWCMJYNSQO-UHFFFAOYSA-N Synonym: 1,3,4-oxadiazole, 2-1,1'-biphenyl-4-yl-5-4-1,1-dimethylethyl phenyl PubChem CID: 84782 IUPAC Name: 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4

2,5-Bis(4-aminophenyl)-1,3,4-oxadiazole 98.0+%, TCI America™

CAS: 2425-95-8 Molecular Formula: C14H12N4O Molecular Weight (g/mol): 252.277 MDL Number: MFCD00042667 InChI Key: MJZXFMSIHMJQBW-UHFFFAOYSA-N Synonym: BAO PubChem CID: 75505 IUPAC Name: 4-[5-(4-aminophenyl)-1,3,4-oxadiazol-2-yl]aniline SMILES: C1=CC(=CC=C1C2=NN=C(O2)C3=CC=C(C=C3)N)N

SB 674042, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 483313-22-0 Molecular Formula: C24H21FN4O2S Molecular Weight (g/mol): 448.516 InChI Key: HYBZWVLPALMACV-KRWDZBQOSA-N Synonym: 2-2s-1-5-2-fluorophenyl-2-methyl-1,3-thiazole-4-carbonyl pyrrolidin-2-yl methyl-5-phenyl-1,3,4-oxadiazole PubChem CID: 10204153 IUPAC Name: [5-(2-fluorophenyl)-2-methyl-1,3-thiazol-4-yl]-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyrrolidin-1-yl]methanone SMILES: CC1=NC(=C(S1)C2=CC=CC=C2F)C(=O)N3CCCC3CC4=NN=C(O4)C5=CC=CC=C5

PD 334581, Tocris Bioscience™

CAS: 548756-68-9 Molecular Formula: C20H19F3IN5O2 Molecular Weight (g/mol): 545.305 InChI Key: LZZYEMSEMRUPIM-UHFFFAOYSA-N Synonym: 5-3,4-difluoro-2-2-fluoro-4-iodo-phenylamino-phenyl-1,3,4 oxadiazol-2-yl-2-morpholin-4-yl-ethyl-amine PubChem CID: 5287529 ChEBI: CHEBI:40187 IUPAC Name: 5-[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-N-(2-morpholin-4-ylethyl)-1,3,4-oxadiazol-2-amine SMILES: C1COCCN1CCNC2=NN=C(O2)C3=C(C(=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F

TC-G 24, Tocris Bioscience™

CAS: 1257256-44-2 Molecular Formula: C15H11ClN4O3 Molecular Weight (g/mol): 330.728 InChI Key: JYCNWQGNEJYDQS-UHFFFAOYSA-N Synonym: n-3-chloro-4-methylphenyl-5-4-nitrophenyl-1,3,4-oxadiazol-2-amine PubChem CID: 49857866 IUPAC Name: N-(3-chloro-4-methylphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-2-amine SMILES: CC1=C(C=C(C=C1)NC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])Cl

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