2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-5-(benzylsulfanyl)-1,3,4-thiadiazole
Chemical Structure Depiction of
2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-5-(benzylsulfanyl)-1,3,4-thiadiazole
2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-5-(benzylsulfanyl)-1,3,4-thiadiazole
Compound characteristics
| Compound ID: | 5696-0042 |
| Compound Name: | 2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-5-(benzylsulfanyl)-1,3,4-thiadiazole |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C20 H17 N5 O2 S3 |
| Smiles: | Cc1nc(c(n1Cc1ccccc1)Sc1nnc(SCc2ccccc2)s1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1678 |
| logD: | 5.1678 |
| logSw: | -5.1433 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.702 |
| InChI Key: | FTGZCZMVAHGSEN-UHFFFAOYSA-N |