N-[(2-chloro-4-fluorophenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
N-[(2-chloro-4-fluorophenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Compound characteristics
| Compound ID: | C267-0220 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea |
| Molecular Weight: | 472.03 |
| Molecular Formula: | C24 H27 Cl F N5 S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(NCc1ccc(cc1[Cl])F)=S |
| Stereo: | ACHIRAL |
| logP: | 5.8094 |
| logD: | 5.1219 |
| logSw: | -6.155 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.167 |
| InChI Key: | KGJVSAFXCJYDKW-UHFFFAOYSA-N |