4-{[(2,4-dichloro-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[(2,4-dichloro-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{[(2,4-dichloro-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2082-0341 |
| Compound Name: | 4-{[(2,4-dichloro-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 405.24 |
| Molecular Formula: | C18 H14 Cl2 N4 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C/c1cc(c(cc1[Cl])[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6707 |
| logD: | 3.6707 |
| logSw: | -3.9695 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.828 |
| InChI Key: | YNVVFSWJWIEJNI-UHFFFAOYSA-N |