N-[3-(azepan-1-yl)propyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
N-[3-(azepan-1-yl)propyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Compound characteristics
| Compound ID: | C267-0109 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea |
| Molecular Weight: | 468.71 |
| Molecular Formula: | C26 H40 N6 S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(NCCCN1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.7646 |
| logD: | 2.3418 |
| logSw: | -4.4351 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.322 |
| InChI Key: | ZHSXCPIUPWETCZ-UHFFFAOYSA-N |