5-amino-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-amino-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-amino-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 0588-0239 |
| Compound Name: | 5-amino-4-[2-(3-nitro[1,1'-biphenyl]-4-yl)hydrazinylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 400.4 |
| Molecular Formula: | C21 H16 N6 O3 |
| Smiles: | c1ccc(cc1)c1ccc(c(c1)[N+]([O-])=O)N/N=C1/C(N)=NN(C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5118 |
| logD: | 4.5048 |
| logSw: | -4.7484 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.776 |
| InChI Key: | MFNWIPABVHIGDT-UHFFFAOYSA-N |