(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)(phenyl)methanone
Chemical Structure Depiction of
(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)(phenyl)methanone
(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | V004-9477 |
| Compound Name: | (4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)(phenyl)methanone |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C24 H25 N5 O3 |
| Smiles: | Cc1c(Cc2ccc(cc2)[N+]([O-])=O)c(nc(C)n1)N1CCN(CC1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9143 |
| logD: | 3.8254 |
| logSw: | -4.0877 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.951 |
| InChI Key: | MCHTUPZFZHXTMG-UHFFFAOYSA-N |