4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2082-0301 |
| Compound Name: | 4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 401.26 |
| Molecular Formula: | C19 H17 Br N2 O3 |
| Smiles: | CC1/C(=C/c2cc(c(cc2[Br])OC)OC)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4144 |
| logD: | 3.4144 |
| logSw: | -3.723 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.848 |
| InChI Key: | LIIODXKQJNFVAT-UHFFFAOYSA-N |