ethyl (2-bromo-4-{[1-(3,4-dimethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetate
Chemical Structure Depiction of
ethyl (2-bromo-4-{[1-(3,4-dimethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetate
ethyl (2-bromo-4-{[1-(3,4-dimethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetate
Compound characteristics
| Compound ID: | 3615-0234 |
| Compound Name: | ethyl (2-bromo-4-{[1-(3,4-dimethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetate |
| Molecular Weight: | 517.38 |
| Molecular Formula: | C24 H25 Br N2 O6 |
| Smiles: | CCOC(COc1c(cc(/C=C2/C(NN(C2=O)c2ccc(C)c(C)c2)=O)cc1[Br])OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2997 |
| logD: | 4.0754 |
| logSw: | -4.2802 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.801 |
| InChI Key: | AKWXTKDWDBTREK-UHFFFAOYSA-N |