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Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
TL;DR: Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate (CAS 52505-56-3) is a chemical compound with molecular formula C12H14N2O2S and molecular weight 250.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
Also Known As: ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate, Maybridge1_006065, BAS 00779554, Ethyl 3-amino-4,6-dimethylthieno(2,3-b)pyridine-2-carboxylate, RefChem:594834
| Molecular Formula | C12H14N2O2S |
|---|---|
| Molecular Weight | 250.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.0776 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 52505-56-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)N |
| InChIKey | NUXMTIQMQARQAV-UHFFFAOYSA-N |
Product Overview
Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate (CAS 52505-56-3), with molecular formula C12H14N2O2S and molecular weight 250.08 g/mol. IUPAC: ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate.
Chemical Property Profile of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
Property Insights of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
The XLogP value of 3.4 indicates that Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate has 1 hydrogen bond donor(s) and 5 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-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate?
The CAS number of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate is 52505-56-3.
What is the molecular formula of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate?
The molecular formula of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate is C12H14N2O2S.
What is the molecular weight of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate?
The molecular weight of Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate is 250.08 g/mol.
Where can I buy Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate?
You can request a quote for Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-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-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.