4-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 5609-0194 |
| Compound Name: | 4-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 415.29 |
| Molecular Formula: | C20 H19 Br N2 O3 |
| Smiles: | CCOc1cc(c(\C=C2/C(C)=NN(C2=O)c2ccccc2)cc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.56 |
| logD: | 3.56 |
| logSw: | -3.6323 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.428 |
| InChI Key: | HUQJSKYICNYFCS-UHFFFAOYSA-N |