N-(2,2-diethoxyethyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(2,2-diethoxyethyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(2,2-diethoxyethyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C756-0007 |
| Compound Name: | N-(2,2-diethoxyethyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C17 H24 N2 O4 S |
| Smiles: | CCOC(CNC(CN1C(CCSc2ccccc12)=O)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.5906 |
| logD: | 1.5906 |
| logSw: | -2.3422 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.347 |
| InChI Key: | DYNZRFYFARUFEE-UHFFFAOYSA-N |