![(E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate structure](/static/products/300/300837-45-0.png)
(E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
TL;DR: (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 300837-45-0) is a chemical compound with molecular formula C25H21N3O5S and molecular weight 475.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E)-5-amino-6-cyano-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Also Known As: (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate, methyl (2E)-5-amino-6-cyano-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
| Molecular Formula | C25H21N3O5S |
|---|---|
| Molecular Weight | 475.12 g/mol |
| LogP | 1.52778 |
| Topological Polar Surface Area | 116.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.12018 |
| Heavy Atoms | 34 |
| Complexity | 1506.9028 |
Chemical Identifiers
| CAS Number | 300837-45-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/2\C(=O)N3C(=C(C(C(=C3S2)C(=O)OC)C4=CC=C(C=C4)OC)C#N)N |
Product Overview
(E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 300837-45-0), with molecular formula C25H21N3O5S and molecular weight 475.12 g/mol. IUPAC: methyl (2E)-5-amino-6-cyano-7-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate.
Chemical Property Profile of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
Property Insights of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
The XLogP value of 1.52778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. The TPSA of 116.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. Following Lipinski's Rule of Five, (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate has 1 hydrogen bond donor(s) and 8 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 (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The CAS number of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 300837-45-0.
What is the molecular formula of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular formula of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is C25H21N3O5S.
What is the molecular weight of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular weight of (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 475.12 g/mol.
Where can I buy (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
You can request a quote for (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 5-amino-6-cyano-2-(4-methoxybenzylidene)-7-(4-methoxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.