5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Chemical Structure Depiction of
5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Compound characteristics
| Compound ID: | 8006-8587 |
| Compound Name: | 5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile |
| Molecular Weight: | 502.55 |
| Molecular Formula: | C26 H22 N4 O5 S |
| Smiles: | CCOc1cc(/C=C2/C(N3C(=C(C#N)C(C(C#N)=C3S2)c2ccc(c(c2)OCC)O)N)=O)ccc1O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7889 |
| logD: | 2.7863 |
| logSw: | -3.012 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 117.919 |
| InChI Key: | NAJITTGRNJCTCL-QHCPKHFHSA-N |