([1,1'-biphenyl]-4-yl)(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
([1,1'-biphenyl]-4-yl)(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
([1,1'-biphenyl]-4-yl)(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V009-4544 |
| Compound Name: | ([1,1'-biphenyl]-4-yl)(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 507.59 |
| Molecular Formula: | C30 H29 N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccc(cc2)[N+]([O-])=O)c(nc(C)n1)N1CCN(CC1)C(c1ccc(cc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7381 |
| logD: | 5.6492 |
| logSw: | -5.7365 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.679 |
| InChI Key: | PLMAJQIGXVRUEQ-UHFFFAOYSA-N |