N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea
N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea
Compound characteristics
| Compound ID: | C267-0448 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-N'-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea |
| Molecular Weight: | 514.49 |
| Molecular Formula: | C24 H28 Br N5 O S |
| Smiles: | Cc1cc(nc2ccc(cc12)NC(NCc1cc(ccc1OC)[Br])=S)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.335 |
| logD: | 4.765 |
| logSw: | -5.5316 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.737 |
| InChI Key: | UYLIZFMMEUSATJ-UHFFFAOYSA-N |