5-(benzylsulfanyl)-1-phenyl-1H-1,2,3,4-tetrazole
5-benzylsulfanyl-1-phenyltetrazole
Also Known As: ChemDiv3_000067|5-benzylsulfanyl-1-phenyltetrazole|5-(benzylthio)-1-phenyl-1H-tetrazole|BI-83B3|1-phenyl-5-benzylsulfanyltetrazole|5-benzylsulfanyl-1-phenyl-tetrazole|5-Benzylthio-1-phenyl-1H-tetrazole|5-(benzylsulfanyl)-1-phenyl-1H-tetrazole|1-Phenyl-5-(benzylthio)-1H-tetrazole|5-Benzylsulfanyl-1-phenyl-1H-tetrazole|IDI1_019385|5-(benzylsulfanyl)-1-phenyl-1H-1,2,3,4-tetrazole|NCGC00172591-01|BAS 00012540|5-(benzylsulfanyl)-1-phenyl-1H-tetraazole|Benzyl 1-phenyl-1H-tetrazole-5-yl sulfide|1H-Tetrazole, 1-phenyl-5-[(phenylmethyl)thio]-|AB00074213-01|AG-690/09706002|1-phenyl-5-(phenylmethylthio)-1,2,3,4-tetraazole|SR-01000390532-1|A0655/0030435
| Molecular Formula | C14H12N4S |
|---|---|
| Molecular Weight | 268.07828 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.07828 |
| Monoisotopic Mass | 268.07828 |
| Heavy Atoms | 19 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 3206-48-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN=NN2C3=CC=CC=C3 |
| InChIKey | YGJVZCBHFFYTPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(benzylsulfanyl)-1-phenyl-1H-1,2,3,4-tetrazole (CAS 3206-48-2), with molecular formula C14H12N4S and molecular weight 268.07828 g/mol. IUPAC: 5-benzylsulfanyl-1-phenyltetrazole.