1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)pentan-1-one
Chemical Structure Depiction of
1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)pentan-1-one
1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)pentan-1-one
Compound characteristics
| Compound ID: | V004-9441 |
| Compound Name: | 1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)pentan-1-one |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Salt: | not_available |
| Smiles: | CCCCC(N1CCN(CC1)c1c(Cc2ccc(cc2)[N+]([O-])=O)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.16 |
| logD: | 6.0849 |
| logSw: | -5.4396 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.811 |
| InChI Key: | HZYCRISREOKDKT-UHFFFAOYSA-N |