![Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate structure](/static/products/3318/331819-57-9.webp)
Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate
TL;DR: Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate (CAS 331819-57-9) is a chemical compound with molecular formula C14H15NO5S and molecular weight 309.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-methyl-4-oxo-7H-thieno[2,3-b]pyridine-2,5-dicarboxylate
Also Known As: Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate, BAS 00600310, AH-262/36680046, diethyl 3-methyl-4-oxo-7H-thieno[2,3-b]pyridine-2,5-dicarboxylate, diethyl 4-hydroxy-3-methylthieno[2,3-b]pyridine-2,5-dicarboxylate
| Molecular Formula | C14H15NO5S |
|---|---|
| Molecular Weight | 309.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.0671 |
| Heavy Atoms | 21 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 331819-57-9 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C1=O)C(=C(S2)C(=O)OCC)C |
| InChIKey | SKVNPWHCFOJYAD-UHFFFAOYSA-N |
Product Overview
Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate (CAS 331819-57-9), with molecular formula C14H15NO5S and molecular weight 309.07 g/mol. IUPAC: diethyl 3-methyl-4-oxo-7H-thieno[2,3-b]pyridine-2,5-dicarboxylate.
Chemical Property Profile of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate
Property Insights of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate has 1 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 Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate?
The CAS number of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate is 331819-57-9.
What is the molecular formula of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate?
The molecular formula of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate is C14H15NO5S.
What is the molecular weight of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate?
The molecular weight of Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate is 309.07 g/mol.
Where can I buy Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate?
You can request a quote for Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3-methyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.