N-butyl-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-butyl-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-4-methylbenzene-1-sulfonamide
N-butyl-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D042-0182 |
| Compound Name: | N-butyl-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 398.52 |
| Molecular Formula: | C22 H26 N2 O3 S |
| Smiles: | CCCCN(Cc1cc2cc(C)ccc2nc1O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3338 |
| logD: | 5.3203 |
| logSw: | -5.2474 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.883 |
| InChI Key: | JGQGVFWXHDBWHA-UHFFFAOYSA-N |