1-[4-(benzenesulfonyl)benzoyl]octahydroquinolin-4(1H)-one
Chemical Structure Depiction of
1-[4-(benzenesulfonyl)benzoyl]octahydroquinolin-4(1H)-one
1-[4-(benzenesulfonyl)benzoyl]octahydroquinolin-4(1H)-one
Compound characteristics
| Compound ID: | 8013-1542 |
| Compound Name: | 1-[4-(benzenesulfonyl)benzoyl]octahydroquinolin-4(1H)-one |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C22 H23 N O4 S |
| Smiles: | C1CCC2C(C1)C(CCN2C(c1ccc(cc1)S(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2508 |
| logD: | 3.2508 |
| logSw: | -3.5369 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.845 |
| InChI Key: | ACKHYAGNJYIIKC-UHFFFAOYSA-N |