2-{[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Chemical Structure Depiction of
2-{[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
2-{[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | 8014-7133 |
| Compound Name: | 2-{[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide |
| Molecular Weight: | 350.87 |
| Molecular Formula: | C16 H19 Cl N4 O S |
| Smiles: | C1CCC(CC1)NC(CSc1nc(c2ccccc2[Cl])[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8713 |
| logD: | 3.8096 |
| logSw: | -4.3208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.671 |
| InChI Key: | UVEWYFMDSTYUHJ-UHFFFAOYSA-N |