(adamantan-1-yl)(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(adamantan-1-yl)(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
(adamantan-1-yl)(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V012-6357 |
| Compound Name: | (adamantan-1-yl)(4-{2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 458.65 |
| Molecular Formula: | C29 H38 N4 O |
| Smiles: | Cc1ccc(Cc2c(C)nc(C)nc2N2CCN(CC2)C(C23CC4CC(CC(C4)C3)C2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4093 |
| logD: | 6.3203 |
| logSw: | -5.7248 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.603 |
| InChI Key: | FXUZIMYBGDMPAR-UHFFFAOYSA-N |