3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y501-0272 |
| Compound Name: | 3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one |
| Molecular Weight: | 366.2 |
| Molecular Formula: | C15 H15 I N2 O |
| Smiles: | CCn1c(C)c(/C=C/C(c2ccc(cc2)I)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 3.7372 |
| logD: | 3.7372 |
| logSw: | -3.9423 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.1389 |
| InChI Key: | NDCGEHDPGMPKRW-UHFFFAOYSA-N |