1-(3-bromophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(3-bromophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
1-(3-bromophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-7106 |
| Compound Name: | 1-(3-bromophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 319.2 |
| Molecular Formula: | C15 H15 Br N2 O |
| Smiles: | Cc1c(/C=C/C(c2cccc(c2)[Br])=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8748 |
| logD: | 2.8748 |
| logSw: | -3.1635 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.0532 |
| InChI Key: | RJKVHWTUCSMPOM-UHFFFAOYSA-N |