N-(3-chlorophenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(3-chlorophenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C714-0185 |
| Compound Name: | N-(3-chlorophenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 422.93 |
| Molecular Formula: | C23 H19 Cl N2 O2 S |
| Smiles: | C1C(c2ccccc2)Sc2ccccc2N(CC(Nc2cccc(c2)[Cl])=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5756 |
| logD: | 5.5753 |
| logSw: | -5.8885 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.828 |
| InChI Key: | XMMIXQXXULALOZ-OAQYLSRUSA-N |