N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C201-1459 |
| Compound Name: | N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 501.96 |
| Molecular Formula: | C25 H19 Cl F3 N3 O S |
| Smiles: | Cc1ccc(cc1)C1CC(=Nc2ccccc2N=1)SCC(Nc1ccc(cc1C(F)(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4028 |
| logD: | 6.4018 |
| logSw: | -6.1095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.641 |
| InChI Key: | HFFATHCJZKUAPF-UHFFFAOYSA-N |