3-{3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-{3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
3-{3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-5266 |
| Compound Name: | 3-{3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C20 H21 Cl N4 O2 |
| Smiles: | Cc1c(c(C)n(Cc2cc(/C=C/C(c3ccnn3C)=O)ccc2OC)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9742 |
| logD: | 2.9742 |
| logSw: | -3.6952 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.776 |
| InChI Key: | WQEYQAOSGNURTB-UHFFFAOYSA-N |