N-benzyl-2-{[4,5-bis(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[4,5-bis(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-benzyl-2-{[4,5-bis(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | V013-6578 |
| Compound Name: | N-benzyl-2-{[4,5-bis(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 469.39 |
| Molecular Formula: | C23 H18 Cl2 N4 O S |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)NC(CSc1nnc(c2ccccc2[Cl])n1c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0913 |
| logD: | 5.0913 |
| logSw: | -5.2441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.883 |
| InChI Key: | QAIDQZIGYKDEFG-UHFFFAOYSA-N |