2-{2-[(4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-N-phenylbenzamide
Chemical Structure Depiction of
2-{2-[(4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-N-phenylbenzamide
2-{2-[(4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-N-phenylbenzamide
Compound characteristics
| Compound ID: | 8018-7180 |
| Compound Name: | 2-{2-[(4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-N-phenylbenzamide |
| Molecular Weight: | 451.55 |
| Molecular Formula: | C23 H25 N5 O3 S |
| Smiles: | C1CCC(CC1)N1C(=NNC1=O)SCC(Nc1ccccc1C(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8619 |
| logD: | 3.8494 |
| logSw: | -4.0582 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.933 |
| InChI Key: | ZMVPWCJZZHZUDT-UHFFFAOYSA-N |