4,4'-[(4-nitrophenyl)methylene]bis[2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
Chemical Structure Depiction of
4,4'-[(4-nitrophenyl)methylene]bis[2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
4,4'-[(4-nitrophenyl)methylene]bis[2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
Compound characteristics
| Compound ID: | 8005-3166 |
| Compound Name: | 4,4'-[(4-nitrophenyl)methylene]bis[2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one] |
| Molecular Weight: | 537.62 |
| Molecular Formula: | C31 H31 N5 O4 |
| Smiles: | CC1C(C(C2C(C)=NN(C2=O)c2ccc(C)c(C)c2)c2ccc(cc2)[N+]([O-])=O)C(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4922 |
| logD: | 3.1936 |
| logSw: | -5.7073 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.317 |
| InChI Key: | XUWLGTGIHPXLNS-UHFFFAOYSA-N |