4-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one
4-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y500-5547 |
| Compound Name: | 4-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 486.16 |
| Molecular Formula: | C21 H14 Br2 N2 O2 |
| Smiles: | CC1/C(=C/c2cc(c(c(c2)[Br])O)[Br])C(N(c2ccc3ccccc3c2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5435 |
| logD: | 5.1234 |
| logSw: | -6.2459 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.794 |
| InChI Key: | NPGQOFQGSKDQLW-UHFFFAOYSA-N |