6-(azepane-1-sulfonyl)-3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-methylquinolin-4(1H)-one
6-(azepane-1-sulfonyl)-3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-0541 |
| Compound Name: | 6-(azepane-1-sulfonyl)-3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 557.11 |
| Molecular Formula: | C28 H33 Cl N4 O4 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(C1=CN(C)c2ccc(cc2C1=O)S(N1CCCCCC1)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0783 |
| logD: | 4.0783 |
| logSw: | -4.5177 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.199 |
| InChI Key: | HKDFKCLAEPVSAH-UHFFFAOYSA-N |