2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide
2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-6333 |
| Compound Name: | 2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C26 H25 N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9502 |
| logD: | 3.949 |
| logSw: | -4.113 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.317 |
| InChI Key: | HGXOWAMCDNNCJK-UHFFFAOYSA-N |