3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | Y500-8285 |
| Compound Name: | 3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide |
| Molecular Weight: | 470.37 |
| Molecular Formula: | C23 H24 Br N3 O3 |
| Smiles: | CCn1cc(CNC(/C=C/c2ccc(c(COc3ccc(cc3)[Br])c2)OC)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2939 |
| logD: | 4.2933 |
| logSw: | -4.2786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.798 |
| InChI Key: | SNBNWTFLXHRXEC-UHFFFAOYSA-N |