{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Chemical Structure Depiction of
{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V008-0559 |
| Compound Name: | {4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone |
| Molecular Weight: | 507.59 |
| Molecular Formula: | C30 H29 N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1nc(C)c(Cc2ccccc2)c(n1)N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5573 |
| logD: | 6.393 |
| logSw: | -5.727 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.066 |
| InChI Key: | PAOZWXDYKVWKQE-UHFFFAOYSA-N |