N-(2,2-diethoxyethyl)-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)propanamide
Chemical Structure Depiction of
N-(2,2-diethoxyethyl)-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)propanamide
N-(2,2-diethoxyethyl)-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)propanamide
Compound characteristics
| Compound ID: | C773-0294 |
| Compound Name: | N-(2,2-diethoxyethyl)-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)propanamide |
| Molecular Weight: | 394.53 |
| Molecular Formula: | C20 H30 N2 O4 S |
| Smiles: | CCOC(CNC(C(C)N1C(CC(C)(C)Sc2ccccc12)=O)=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4456 |
| logD: | 2.4456 |
| logSw: | -2.558 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.901 |
| InChI Key: | OYDVLFGNDHKGLT-AWEZNQCLSA-N |