3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | Y500-8944 |
| Compound Name: | 3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide |
| Molecular Weight: | 504.81 |
| Molecular Formula: | C23 H23 Br Cl N3 O3 |
| Smiles: | CCn1cc(CNC(/C=C/c2ccc(c(COc3ccc(cc3[Br])[Cl])c2)OC)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 4.693 |
| logD: | 4.6925 |
| logSw: | -5.0552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.885 |
| InChI Key: | AYJBTBJMRJELCE-UHFFFAOYSA-N |