Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate
TL;DR: Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate (CAS 52505-73-4) is a chemical compound with molecular formula C11H11N3O4S and molecular weight 281.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate
Also Known As: AH-262/31831036, methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate, methyl 3-amino-5-nitro-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
| Molecular Formula | C11H11N3O4S |
|---|---|
| Molecular Weight | 281.05 g/mol |
| LogP | 2.19014 |
| Topological Polar Surface Area | 108.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.04703 |
| Heavy Atoms | 19 |
| Complexity | 707.7636 |
Chemical Identifiers
| CAS Number | 52505-73-4 |
|---|---|
| SMILES | CC1=C2C(=C(SC2=NC(=C1[N+](=O)[O-])C)C(=O)OC)N |
Product Overview
Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate (CAS 52505-73-4), with molecular formula C11H11N3O4S and molecular weight 281.05 g/mol. IUPAC: methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate.
Chemical Property Profile of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate
Property Insights of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate
The XLogP value of 2.19014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate. The TPSA of 108.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-amino-4,6-dimethyl-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
Frequently Asked Questions
What is the CAS number of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The CAS number of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate is 52505-73-4.
What is the molecular formula of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The molecular formula of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate is C11H11N3O4S.
What is the molecular weight of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
The molecular weight of Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate is 281.05 g/mol.
Where can I buy Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
You can request a quote for Methyl 3-amino-4,6-dimethyl-5-nitrothieno[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 Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-amino-4,6-dimethyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.