N-[4-(4a-chloro-1-phenyloctahydroisoquinoline-2(1H)-sulfonyl)phenyl]acetamide
Chemical Structure Depiction of
N-[4-(4a-chloro-1-phenyloctahydroisoquinoline-2(1H)-sulfonyl)phenyl]acetamide
N-[4-(4a-chloro-1-phenyloctahydroisoquinoline-2(1H)-sulfonyl)phenyl]acetamide
Compound characteristics
| Compound ID: | 7287-0652 |
| Compound Name: | N-[4-(4a-chloro-1-phenyloctahydroisoquinoline-2(1H)-sulfonyl)phenyl]acetamide |
| Molecular Weight: | 447 |
| Molecular Formula: | C23 H27 Cl N2 O3 S |
| Smiles: | CC(Nc1ccc(cc1)S(N1CCC2(CCCCC2C1c1ccccc1)[Cl])(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4941 |
| logD: | 4.4937 |
| logSw: | -4.6766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.155 |
| InChI Key: | QIBNWTPIJPLNAK-UHFFFAOYSA-N |