(4Z)-1-[3-(diethylamino)propyl]-4-[(2,3-dihydro-1,4-benzodioxin-6-yl)(hydroxy)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Chemical Structure Depiction of
(4Z)-1-[3-(diethylamino)propyl]-4-[(2,3-dihydro-1,4-benzodioxin-6-yl)(hydroxy)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
(4Z)-1-[3-(diethylamino)propyl]-4-[(2,3-dihydro-1,4-benzodioxin-6-yl)(hydroxy)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Compound characteristics
| Compound ID: | IB02-4208 |
| Compound Name: | (4Z)-1-[3-(diethylamino)propyl]-4-[(2,3-dihydro-1,4-benzodioxin-6-yl)(hydroxy)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione |
| Molecular Weight: | 466.53 |
| Molecular Formula: | C26 H30 N2 O6 |
| Smiles: | CCN(CC)CCCN1C(\C(=C(/c2ccc3c(c2)OCCO3)O)C(C1=O)=O)c1ccc(cc1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.05 |
| logD: | -0.23 |
| logSw: | -2.73 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 167.86 |
| InChI Key: | JPUHGPARXYZASL-QHCPKHFHSA-N |