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Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate
TL;DR: Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate (CAS 52505-43-8) is a chemical compound with molecular formula C10H9N3O4S and molecular weight 267.03137 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate
Also Known As: ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate, 7412AB, Ethyl3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate, Ethyl 3-amino-5-nitrothieno-[2,3-b]pyridine-2-carboxylate, 3-Amino-5-nitrothieno[2,3-b]pyridine-2-carboxylic acid ethyl ester
Technical Specifications
| Molecular Formula | C10H9N3O4S |
| Molecular Weight | 267.03137 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.03137 Da |
| Heavy Atoms | 18 |
| Complexity | 349.0 |
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=CC(=C2)[N+](=O)[O-])N |
| InChIKey | BFKHPDPSYGZJLE-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate
Property Insights of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate 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
What is the CAS number of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The CAS number of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate is 52505-43-8.
What is the molecular formula of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The molecular formula of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate is C10H9N3O4S.
What is the molecular weight of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The molecular weight of Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate is 267.03137 g/mol.
Where can I buy Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
You can request a quote for Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3-amino-5-nitrothieno[2,3-b]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.