2-(benzyloxy)-1-(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(benzyloxy)-1-(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
2-(benzyloxy)-1-(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V013-7928 |
| Compound Name: | 2-(benzyloxy)-1-(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 444.58 |
| Molecular Formula: | C27 H32 N4 O2 |
| Smiles: | Cc1ccc(Cc2c(C)nc(C)nc2N2CCN(CC2)C(COCc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3456 |
| logD: | 4.2567 |
| logSw: | -4.4095 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.476 |
| InChI Key: | QHGFGERRZOHBRZ-UHFFFAOYSA-N |