3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(5-methylthiophen-2-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(5-methylthiophen-2-yl)prop-2-en-1-one
3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(5-methylthiophen-2-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y500-3889 |
| Compound Name: | 3-{4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}-1-(5-methylthiophen-2-yl)prop-2-en-1-one |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C19 H18 N2 O2 S |
| Smiles: | Cc1ccc(C(/C=C\c2ccc(c(Cn3cccn3)c2)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1648 |
| logD: | 4.1647 |
| logSw: | -4.3561 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.386 |
| InChI Key: | UVSCYCDCYSBWFS-UHFFFAOYSA-N |