4-{[1-(3,4-dichlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
Chemical Structure Depiction of
4-{[1-(3,4-dichlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
4-{[1-(3,4-dichlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate
Compound characteristics
| Compound ID: | 2083-0081 |
| Compound Name: | 4-{[1-(3,4-dichlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenyl acetate |
| Molecular Weight: | 433.29 |
| Molecular Formula: | C21 H18 Cl2 N2 O4 |
| Smiles: | CCOc1cc(\C=C2/C(C)=NN(C2=O)c2ccc(c(c2)[Cl])[Cl])ccc1OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5887 |
| logD: | 4.5887 |
| logSw: | -4.9276 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.635 |
| InChI Key: | FVOWRICERHTKTC-UHFFFAOYSA-N |