N-(3-chloro-4-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C200-6344 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 449.96 |
| Molecular Formula: | C24 H20 Cl N3 O2 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0802 |
| logD: | 5.0791 |
| logSw: | -5.4797 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.969 |
| InChI Key: | XLFNLJFHSZXSJJ-UHFFFAOYSA-N |