N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea
Compound characteristics
| Compound ID: | C267-0212 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea |
| Molecular Weight: | 528.51 |
| Molecular Formula: | C25 H30 Br N5 O S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(NCc1cc(ccc1OC)[Br])=S |
| Stereo: | ACHIRAL |
| logP: | 5.6797 |
| logD: | 4.9922 |
| logSw: | -5.649 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.797 |
| InChI Key: | KVAMVVMKRFGHIJ-UHFFFAOYSA-N |