1-(3-bromophenyl)-4-[(3,4-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3-bromophenyl)-4-[(3,4-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
1-(3-bromophenyl)-4-[(3,4-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 4357-0620 |
| Compound Name: | 1-(3-bromophenyl)-4-[(3,4-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione |
| Molecular Weight: | 431.28 |
| Molecular Formula: | C20 H19 Br N2 O4 |
| Smiles: | CCOc1ccc(\C=C2/C(NN(C2=O)c2cccc(c2)[Br])=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.3799 |
| logD: | 3.0315 |
| logSw: | -3.6103 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.18 |
| InChI Key: | UTILPFVDJDVGAY-UHFFFAOYSA-N |