ethyl N-{[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetyl}glycinate
Chemical Structure Depiction of
ethyl N-{[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetyl}glycinate
ethyl N-{[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetyl}glycinate
Compound characteristics
| Compound ID: | C714-0379 |
| Compound Name: | ethyl N-{[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetyl}glycinate |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C23 H26 N2 O6 S |
| Smiles: | CCOC(CNC(CN1C(CC(c2ccc(c(c2)OC)OC)Sc2ccccc12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.849 |
| logD: | 2.849 |
| logSw: | -3.3574 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.841 |
| InChI Key: | KUKOPVLWXIUEBD-FQEVSTJZSA-N |