2-methyl-1-(4-{6-methyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)propan-1-one
Chemical Structure Depiction of
2-methyl-1-(4-{6-methyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)propan-1-one
2-methyl-1-(4-{6-methyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | V027-2337 |
| Compound Name: | 2-methyl-1-(4-{6-methyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)propan-1-one |
| Molecular Weight: | 439.56 |
| Molecular Formula: | C24 H33 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(C)c(Cc2ccc(cc2)[N+]([O-])=O)c(n1)N1CCN(CC1)C(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1291 |
| logD: | 4.9584 |
| logSw: | -4.9789 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.6 |
| InChI Key: | VKMURHDPEJJGJX-UHFFFAOYSA-N |