3-chloro-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Chemical Structure Depiction of
3-chloro-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
3-chloro-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Compound characteristics
| Compound ID: | C095-0391 |
| Compound Name: | 3-chloro-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide |
| Molecular Weight: | 458.95 |
| Molecular Formula: | C25 H23 Cl N6 O |
| Smiles: | Cc1cc(nc2ccc(cc12)NC(c1cccc(c1)[Cl])=O)N1CCN(CC1)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 5.9519 |
| logD: | 5.9399 |
| logSw: | -6.1461 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.199 |
| InChI Key: | DZYFIPJQOYHYFB-UHFFFAOYSA-N |