3-(5-bromo-2-methoxyphenyl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(5-bromo-2-methoxyphenyl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
3-(5-bromo-2-methoxyphenyl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-8435 |
| Compound Name: | 3-(5-bromo-2-methoxyphenyl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 349.23 |
| Molecular Formula: | C16 H17 Br N2 O2 |
| Smiles: | Cc1c(C(/C=C/c2cc(ccc2OC)[Br])=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0321 |
| logD: | 3.0321 |
| logSw: | -3.1721 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.684 |
| InChI Key: | VWUFGXYGHGOLFC-UHFFFAOYSA-N |