[2,2-dimethyl-4-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}quinolin-1(2H)-yl](phenyl)methanone
Chemical Structure Depiction of
[2,2-dimethyl-4-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}quinolin-1(2H)-yl](phenyl)methanone
[2,2-dimethyl-4-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}quinolin-1(2H)-yl](phenyl)methanone
Compound characteristics
| Compound ID: | Y021-0876 |
| Compound Name: | [2,2-dimethyl-4-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}quinolin-1(2H)-yl](phenyl)methanone |
| Molecular Weight: | 439.56 |
| Molecular Formula: | C27 H29 N5 O |
| Smiles: | CC1(C)C=C(CN2CCN(CC2)c2ncccn2)c2ccccc2N1C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3324 |
| logD: | 4.1872 |
| logSw: | -4.3125 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.679 |
| InChI Key: | KGBVWWAIWIDIDW-UHFFFAOYSA-N |