N-[2-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G731-0150 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 412.9 |
| Molecular Formula: | C19 H17 Cl N6 O S |
| Smiles: | C(CNC(CSc1nnc(c2ccccc2[Cl])[nH]1)=O)c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.4631 |
| logD: | 1.2714 |
| logSw: | -3.5147 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.068 |
| InChI Key: | KONDXCIZMQIJHF-UHFFFAOYSA-N |