3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-6-(3,5-dimethylpiperidine-1-sulfonyl)-1-ethylquinolin-4(1H)-one
Chemical Structure Depiction of
3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-6-(3,5-dimethylpiperidine-1-sulfonyl)-1-ethylquinolin-4(1H)-one
3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-6-(3,5-dimethylpiperidine-1-sulfonyl)-1-ethylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-1910 |
| Compound Name: | 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-6-(3,5-dimethylpiperidine-1-sulfonyl)-1-ethylquinolin-4(1H)-one |
| Molecular Weight: | 585.17 |
| Molecular Formula: | C30 H37 Cl N4 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CC(C)CC(C)C1)(=O)=O)=O)C(N1CCN(CC1)c1cc(ccc1C)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1681 |
| logD: | 5.1681 |
| logSw: | -5.4109 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.744 |
| InChI Key: | GIQMPTFGXGRMHP-UHFFFAOYSA-N |