ethyl 5-amino-8-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-8-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate
ethyl 5-amino-8-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate
Compound characteristics
Compound ID: | 8006-4361 |
Compound Name: | ethyl 5-amino-8-cyano-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate |
Molecular Weight: | 461.5 |
Molecular Formula: | C24 H19 N3 O5 S |
Smiles: | CCOC(C1C(C(C#N)=C2N(C=1N)C(/C(=C/c1ccc(cc1)O)S2)=O)c1ccc(cc1)O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6217 |
logD: | 2.6193 |
logSw: | -2.7371 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 109.334 |
InChI Key: | YGDAZDBNHJGUDJ-IBGZPJMESA-N |