![isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate structure](/static/products/461/461431-65-2.png)
isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
TL;DR: isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 461431-65-2) is a chemical compound with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-amino-6-cyano-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Also Known As: isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate, propan-2-yl 5-amino-6-cyano-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate, 5-Amino-6-cyano-3-oxo-2,3-dihydro-7H-thiazolo[3,2-a]pyridine-8-carboxylic acid isopropyl ester, propan-2-yl 5-amino-6-cyano-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
| Molecular Formula | C12H13N3O3S |
|---|---|
| Molecular Weight | 279.07 g/mol |
| LogP | 0.82258 |
| Topological Polar Surface Area | 96.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.06775 |
| Heavy Atoms | 19 |
| Complexity | 557.0571 |
Chemical Identifiers
| CAS Number | 461431-65-2 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C2N(C(=O)CS2)C(=C(C1)C#N)N |
Product Overview
isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate (CAS 461431-65-2), with molecular formula C12H13N3O3S and molecular weight 279.07 g/mol. IUPAC: propan-2-yl 5-amino-6-cyano-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate.
Chemical Property Profile of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
Property Insights of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate
The XLogP value of 0.82258 suggests moderate lipophilicity, balancing water solubility and membrane permeability for isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. The TPSA of 96.42 Ų falls within the moderate polarity range, balancing permeability and solubility for isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate. Following Lipinski's Rule of Five, isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate has 1 hydrogen bond donor(s) and 6 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 isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The CAS number of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 461431-65-2.
What is the molecular formula of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular formula of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is C12H13N3O3S.
What is the molecular weight of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
The molecular weight of isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate is 279.07 g/mol.
Where can I buy isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
You can request a quote for isopropyl 5-amino-6-cyano-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 isopropyl 5-amino-6-cyano-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-8-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 5-amino-6-cyano-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.