3-(5-bromo-2-hydroxyphenyl)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(5-bromo-2-hydroxyphenyl)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
3-(5-bromo-2-hydroxyphenyl)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y500-8794 |
| Compound Name: | 3-(5-bromo-2-hydroxyphenyl)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 335.2 |
| Molecular Formula: | C15 H15 Br N2 O2 |
| Smiles: | CCn1c(C)c(cn1)C(/C=C/c1cc(ccc1O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2998 |
| logD: | 3.0398 |
| logSw: | -3.0554 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.687 |
| InChI Key: | ZYCDFEMSHCWATA-UHFFFAOYSA-N |