4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 5784-0383 |
| Compound Name: | 4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C21 H21 Br N2 O3 |
| Smiles: | CCCC1/C(=C\c2cc(c(cc2[Br])OC)OC)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3191 |
| logD: | 4.3191 |
| logSw: | -4.3751 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.578 |
| InChI Key: | WJUHLKNUFWFHQM-UHFFFAOYSA-N |