methyl 5-amino-6-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Chemical Structure Depiction of
methyl 5-amino-6-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
methyl 5-amino-6-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Compound characteristics
| Compound ID: | 2435-0073 |
| Compound Name: | methyl 5-amino-6-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate |
| Molecular Weight: | 447.47 |
| Molecular Formula: | C23 H17 N3 O5 S |
| Smiles: | COC(C1C(C(C#N)=C(N)N2C=1SC(=C\c1ccc(cc1)O)\C2=O)c1ccc(cc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1811 |
| logD: | 2.1788 |
| logSw: | -2.394 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.754 |
| InChI Key: | GAYFTKXWWUFPOM-SFHVURJKSA-N |