4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4228-0478 |
| Compound Name: | 4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 357.2 |
| Molecular Formula: | C17 H13 Br N2 O2 |
| Smiles: | CC1/C(=C\c2ccc(c(c2)[Br])O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5431 |
| logD: | 3.504 |
| logSw: | -3.3567 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.135 |
| InChI Key: | KCFYAJPHEPFFGY-UHFFFAOYSA-N |