5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile
TL;DR: 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile (CAS 328070-77-5) is a chemical compound with molecular formula C22H14N4O3S and molecular weight 414.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Also Known As: 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile, (2Z)-5-amino-2-(4-hydroxybenzylidene)-7-(4-hydroxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile, (2Z)-5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile, (Z)-5-amino-2-(4-hydroxybenzylidene)-7-(4-hydroxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile, 5-amino-2-(4-hydroxybenzylidene)-7-(4-hydroxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
| Molecular Formula | C22H14N4O3S |
|---|---|
| Molecular Weight | 414.08 g/mol |
| LogP | 1.27236 |
| Topological Polar Surface Area | 136.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.07867 |
| Heavy Atoms | 30 |
| Complexity | 1447.4863 |
Chemical Identifiers
| CAS Number | 328070-77-5 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=C\2/C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC=C(C=C4)O)C#N)N)O |
Product Overview
5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile (CAS 328070-77-5), with molecular formula C22H14N4O3S and molecular weight 414.08 g/mol. IUPAC: (2Z)-5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile.
Chemical Property Profile of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile
Property Insights of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile
The XLogP value of 1.27236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile. The TPSA of 136.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile. Following Lipinski's Rule of Five, 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile?
The CAS number of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile is 328070-77-5.
What is the molecular formula of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile?
The molecular formula of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile is C22H14N4O3S.
What is the molecular weight of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile?
The molecular weight of 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile is 414.08 g/mol.
Where can I buy 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile?
You can request a quote for 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-7-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylene]-3-oxo-4,7-dihydro-1 ,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.