N-(2,5-dimethoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(2,5-dimethoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C714-0198 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C25 H24 N2 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CN1C(CC(c2ccccc2)Sc2ccccc12)=O)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5054 |
| logD: | 4.5045 |
| logSw: | -4.3046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.304 |
| InChI Key: | MAEJJMWIARIQTB-QHCPKHFHSA-N |