N-(2,6-dimethylphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(2,6-dimethylphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C200-6340 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C25 H23 N3 O S |
| Smiles: | Cc1cccc(C)c1NC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7543 |
| logD: | 4.7536 |
| logSw: | -4.5242 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.943 |
| InChI Key: | LEGYLTJHYHDNEY-UHFFFAOYSA-N |