4-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
Chemical Structure Depiction of
4-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
4-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
Compound characteristics
| Compound ID: | 2082-0453 |
| Compound Name: | 4-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate |
| Molecular Weight: | 398.84 |
| Molecular Formula: | C21 H19 Cl N2 O4 |
| Smiles: | CCOc1cc(/C=C2/C(C)=NN(C2=O)c2cccc(c2)[Cl])ccc1OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8893 |
| logD: | 3.8893 |
| logSw: | -4.5601 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.635 |
| InChI Key: | AVIHRKZFYMGWFH-UHFFFAOYSA-N |