N-(2,3-dimethylcyclohexyl)-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
N-(2,3-dimethylcyclohexyl)-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Compound characteristics
| Compound ID: | C267-0049 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea |
| Molecular Weight: | 439.67 |
| Molecular Formula: | C25 H37 N5 S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(NC1CCCC(C)C1C)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5117 |
| logD: | 4.8242 |
| logSw: | -5.5616 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.282 |
| InChI Key: | BBKFSQKHUCOXND-UHFFFAOYSA-N |