2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(2,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(2,5-dimethylphenyl)acetamide
2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(2,5-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C714-0338 |
| Compound Name: | 2-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-(2,5-dimethylphenyl)acetamide |
| Molecular Weight: | 476.59 |
| Molecular Formula: | C27 H28 N2 O4 S |
| Smiles: | Cc1ccc(C)c(c1)NC(CN1C(CC(c2ccc(c(c2)OC)OC)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4911 |
| logD: | 4.491 |
| logSw: | -4.3114 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.391 |
| InChI Key: | KJQBAJLMZVQQIM-VWLOTQADSA-N |