N-(5-chloro-2-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C200-6334 |
| Compound Name: | N-(5-chloro-2-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(cc1NC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8225 |
| logD: | 4.817 |
| logSw: | -4.8848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.271 |
| InChI Key: | QUPYYFONXASGSI-UHFFFAOYSA-N |