N-(3-chloro-4-methylphenyl)-2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-(3-chloro-4-methylphenyl)-2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | C714-0352 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 497.01 |
| Molecular Formula: | C26 H25 Cl N2 O4 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CN1C(CC(c2ccc(c(c2)OC)OC)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8401 |
| logD: | 5.8397 |
| logSw: | -5.9829 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.089 |
| InChI Key: | WNXOJNZYUVZKQN-XMMPIXPASA-N |