1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)butan-2-ol
Chemical Structure Depiction of
1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)butan-2-ol
1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)butan-2-ol
Compound characteristics
| Compound ID: | V007-9749 |
| Compound Name: | 1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)butan-2-ol |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H31 N5 O3 |
| Salt: | not_available |
| Smiles: | CCC(CN1CCN(CC1)c1c(Cc2ccc(cc2)[N+]([O-])=O)c(C)nc(c2ccccc2)n1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3516 |
| logD: | 4.8463 |
| logSw: | -5.2762 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.042 |
| InChI Key: | KFYZYYFGLUVTGA-QHCPKHFHSA-N |