ethyl (2-{[1-(4-ethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate
Chemical Structure Depiction of
ethyl (2-{[1-(4-ethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate
ethyl (2-{[1-(4-ethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate
Compound characteristics
| Compound ID: | 4489-8873 |
| Compound Name: | ethyl (2-{[1-(4-ethylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C22 H22 N2 O5 |
| Smiles: | CCc1ccc(cc1)N1C(C(=C/c2ccccc2OCC(=O)OCC)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3535 |
| logD: | 3.3131 |
| logSw: | -3.5452 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.504 |
| InChI Key: | WHTRKPDTRYPXJG-UHFFFAOYSA-N |