4-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide
Chemical Structure Depiction of
4-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide
4-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide
Compound characteristics
| Compound ID: | V001-1056 |
| Compound Name: | 4-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide |
| Molecular Weight: | 428.56 |
| Molecular Formula: | C25 H24 N4 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC(CCCSc1nnc(c2ccccc2)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1234 |
| logD: | 5.1234 |
| logSw: | -4.9319 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.862 |
| InChI Key: | FAAHSVNXTINBSY-UHFFFAOYSA-N |