N-(5-chloro-2-methoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(5-chloro-2-methoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C714-0191 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-(4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C24 H21 Cl N2 O3 S |
| Smiles: | COc1ccc(cc1NC(CN1C(CC(c2ccccc2)Sc2ccccc12)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0749 |
| logD: | 5.0678 |
| logSw: | -5.2646 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.76 |
| InChI Key: | ZYINCGIRFPGJJN-JOCHJYFZSA-N |