(4-{5-[(2,5-dimethylphenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)(3-nitrophenyl)methanone
Chemical Structure Depiction of
(4-{5-[(2,5-dimethylphenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)(3-nitrophenyl)methanone
(4-{5-[(2,5-dimethylphenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V008-5787 |
| Compound Name: | (4-{5-[(2,5-dimethylphenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)(3-nitrophenyl)methanone |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(Cc2c(C)nc(C)nc2N2CCN(CC2)C(c2cccc(c2)[N+]([O-])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.125 |
| logD: | 4.7678 |
| logSw: | -5.0792 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.951 |
| InChI Key: | CRZBWJKOZHLYBU-UHFFFAOYSA-N |