N-(3,4-dimethoxyphenyl)-2-(2-methyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-(2-methyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(3,4-dimethoxyphenyl)-2-(2-methyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C714-0118 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-(2-methyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C20 H22 N2 O4 S |
| Smiles: | CC1CC(N(CC(Nc2ccc(c(c2)OC)OC)=O)c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0072 |
| logD: | 3.0071 |
| logSw: | -3.4331 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.36 |
| InChI Key: | XDJXSGIQDOOSOR-ZDUSSCGKSA-N |