ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate
TL;DR: ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate (CAS 329909-33-3) is a chemical compound with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-2-benzoyl-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate
Also Known As: ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate, ethyl 3-amino-2-benzoyl-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate, ethyl 3-amino-6-oxo-2-(phenylcarbonyl)-7-hydrothiopheno[2,3-b]pyridine-5-carbo xylate, Ethyl 9-amino-8-benzoyl-4-oxo-7-thia-5-azabicyclo[4.3.0]nona-2,8,10-triene-3-carboxylate
| Molecular Formula | C17H14N2O4S |
|---|---|
| Molecular Weight | 342.07 g/mol |
| LogP | 2.5795 |
| Topological Polar Surface Area | 102.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0674 |
| Heavy Atoms | 24 |
| Complexity | 988.98834 |
Chemical Identifiers
| CAS Number | 329909-33-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(NC1=O)SC(=C2N)C(=O)C3=CC=CC=C3 |
Product Overview
ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate (CAS 329909-33-3), with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol. IUPAC: ethyl 3-amino-2-benzoyl-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate.
Chemical Property Profile of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate
Property Insights of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate
The XLogP value of 2.5795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate. The TPSA of 102.25 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate. Following Lipinski's Rule of Five, ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate has 2 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 ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate?
The CAS number of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate is 329909-33-3.
What is the molecular formula of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate?
The molecular formula of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate is C17H14N2O4S.
What is the molecular weight of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate?
The molecular weight of ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate is 342.07 g/mol.
Where can I buy ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate?
You can request a quote for ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.