N-(2-chloro-4-methylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(2-chloro-4-methylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | L389-0057 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C26 H24 Cl N3 O S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSC1CC(c2ccccc2)=Nc2cc(C)c(C)cc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2461 |
| logD: | 6.24 |
| logSw: | -6.0546 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.641 |
| InChI Key: | PKPHJFDOBDYUCZ-UHFFFAOYSA-N |