4-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-7-chloro-1-methylquinolin-2(1H)-one
Chemical Structure Depiction of
4-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-7-chloro-1-methylquinolin-2(1H)-one
4-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-7-chloro-1-methylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | C463-0311 |
| Compound Name: | 4-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-7-chloro-1-methylquinolin-2(1H)-one |
| Molecular Weight: | 441.98 |
| Molecular Formula: | C23 H24 Cl N3 O2 S |
| Smiles: | CN1C(C=C(c2ccc(cc12)[Cl])SCC(N1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1535 |
| logD: | 3.1438 |
| logSw: | -3.5973 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.318 |
| InChI Key: | YJHIGLANYIMNOR-UHFFFAOYSA-N |