2-(3-methylphenoxy)-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}acetamide
Chemical Structure Depiction of
2-(3-methylphenoxy)-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}acetamide
2-(3-methylphenoxy)-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}acetamide
Compound characteristics
| Compound ID: | C095-0437 |
| Compound Name: | 2-(3-methylphenoxy)-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}acetamide |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C27 H28 N6 O2 |
| Smiles: | Cc1cccc(c1)OCC(Nc1ccc2c(c1)c(C)cc(n2)N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8147 |
| logD: | 5.8145 |
| logSw: | -5.5299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.485 |
| InChI Key: | QHCNURFECSSDDO-UHFFFAOYSA-N |