4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1685-0017 |
| Compound Name: | 4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 370.79 |
| Molecular Formula: | C18 H15 Cl N4 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C\c1ccc(c(c1)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.6795 |
| logD: | 2.6795 |
| logSw: | -3.4872 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.828 |
| InChI Key: | KQKIASXYHXCNJG-UHFFFAOYSA-N |