5-methyl-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-methyl-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1313-0147 |
| Compound Name: | 5-methyl-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 399.41 |
| Molecular Formula: | C22 H17 N5 O3 |
| Smiles: | CC1\C(C(N(c2ccccc2)N=1)=O)=N/Nc1ccc(cc1[N+]([O-])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4957 |
| logD: | 5.4912 |
| logSw: | -5.5589 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.673 |
| InChI Key: | XONQYMMSOULVHN-UHFFFAOYSA-N |