3-{5-[(3-chlorophenoxy)methyl]furan-2-yl}-1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-{5-[(3-chlorophenoxy)methyl]furan-2-yl}-1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
3-{5-[(3-chlorophenoxy)methyl]furan-2-yl}-1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-4900 |
| Compound Name: | 3-{5-[(3-chlorophenoxy)methyl]furan-2-yl}-1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 370.83 |
| Molecular Formula: | C20 H19 Cl N2 O3 |
| Smiles: | CCn1cc(C(/C=C/c2ccc(COc3cccc(c3)[Cl])o2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3979 |
| logD: | 4.3979 |
| logSw: | -4.5673 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.308 |
| InChI Key: | HUMXVWSTLSEVMI-UHFFFAOYSA-N |