3-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
3-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-0369 |
| Compound Name: | 3-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one |
| Molecular Weight: | 352.17 |
| Molecular Formula: | C14 H13 I N2 O |
| Smiles: | Cc1c(/C=C/C(c2ccc(cc2)I)=O)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2087 |
| logD: | 3.2087 |
| logSw: | -3.1112 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.3758 |
| InChI Key: | PRQFHNODSXSBBB-UHFFFAOYSA-N |