3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-5437 |
| Compound Name: | 3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C18 H18 N4 O2 |
| Smiles: | Cn1c(ccn1)C(/C=C\c1ccc(c(Cn2cccn2)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9431 |
| logD: | 1.9431 |
| logSw: | -2.5652 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.017 |
| InChI Key: | WGAVTIBOFLMDTH-UHFFFAOYSA-N |