{4-[6-methyl-2-(3-methylphenyl)-5-(propan-2-yl)pyrimidin-4-yl]piperazin-1-yl}(4-nitrophenyl)methanone
Chemical Structure Depiction of
{4-[6-methyl-2-(3-methylphenyl)-5-(propan-2-yl)pyrimidin-4-yl]piperazin-1-yl}(4-nitrophenyl)methanone
{4-[6-methyl-2-(3-methylphenyl)-5-(propan-2-yl)pyrimidin-4-yl]piperazin-1-yl}(4-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V009-5258 |
| Compound Name: | {4-[6-methyl-2-(3-methylphenyl)-5-(propan-2-yl)pyrimidin-4-yl]piperazin-1-yl}(4-nitrophenyl)methanone |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)c1c(C)nc(c2cccc(C)c2)nc1N1CCN(CC1)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9607 |
| logD: | 5.7609 |
| logSw: | -5.5058 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.338 |
| InChI Key: | FGJBLIWZMRLTCR-UHFFFAOYSA-N |