4-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Chemical Structure Depiction of
4-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
4-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 3584-1397 |
| Compound Name: | 4-[(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione |
| Molecular Weight: | 485.5 |
| Molecular Formula: | C27 H23 N3 O6 |
| Smiles: | C=CCc1ccccc1OCCOc1ccc(cc1\C=C1/C(NN(C1=O)c1ccccc1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9032 |
| logD: | 4.8709 |
| logSw: | -5.0031 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.879 |
| InChI Key: | SRJPTLINWYYKJR-UHFFFAOYSA-N |