2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(4-ethoxyphenyl)acetamide
2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C714-0358 |
| Compound Name: | 2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 492.59 |
| Molecular Formula: | C27 H28 N2 O5 S |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(CC(c2ccc(c(c2)OC)OC)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8188 |
| logD: | 4.8188 |
| logSw: | -4.4319 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.212 |
| InChI Key: | LKRYFFZUPBDTHA-VWLOTQADSA-N |