6-chloro-4-({2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-4-({2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinolin-2(1H)-one
6-chloro-4-({2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | C547-0274 |
| Compound Name: | 6-chloro-4-({2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinolin-2(1H)-one |
| Molecular Weight: | 445.94 |
| Molecular Formula: | C22 H21 Cl F N3 O2 S |
| Smiles: | CN1C(C=C(c2cc(ccc12)[Cl])SCC(N1CCN(CC1)c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6165 |
| logD: | 3.6165 |
| logSw: | -4.0428 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.736 |
| InChI Key: | QSIAOCVMPFFOGJ-UHFFFAOYSA-N |