4-({[4-(diethylamino)-3-nitrophenyl]methylidene}amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({[4-(diethylamino)-3-nitrophenyl]methylidene}amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-({[4-(diethylamino)-3-nitrophenyl]methylidene}amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1685-0014 |
| Compound Name: | 4-({[4-(diethylamino)-3-nitrophenyl]methylidene}amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H25 N5 O3 |
| Smiles: | CCN(CC)c1ccc(\C=N/C2=C(C)N(C)N(C2=O)c2ccccc2)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9007 |
| logD: | 2.9007 |
| logSw: | -3.5985 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.263 |
| InChI Key: | XLXNKBFIUHLFPE-UHFFFAOYSA-N |