N-benzyl-2-{[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-benzyl-2-{[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | V029-8330 |
| Compound Name: | N-benzyl-2-{[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 372.87 |
| Molecular Formula: | C18 H17 Cl N4 O S |
| Salt: | not_available |
| Smiles: | Cc1nnc(n1c1cccc(c1)[Cl])SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9287 |
| logD: | 2.9287 |
| logSw: | -3.5202 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.232 |
| InChI Key: | YTXBTPWMXLPNFK-UHFFFAOYSA-N |