Compound 7
TL;DR: Compound 7 (CAS 439946-22-2) is a chemical compound with molecular formula C15H10N2O4S and molecular weight 314.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-benzoyl-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid
Also Known As: Compound 7, ChemDiv2_004146, UCH-L1 Inhibitor II, 3-amino-2-benzoyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxylic acid, IDI1_002861
| Molecular Formula | C15H10N2O4S |
|---|---|
| Molecular Weight | 314.04 g/mol |
| LogP | 2.101 |
| Topological Polar Surface Area | 113.25 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.03613 |
| Heavy Atoms | 22 |
| Complexity | 956.82806 |
Chemical Identifiers
| CAS Number | 439946-22-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N |
Product Overview
Compound 7 (CAS 439946-22-2), with molecular formula C15H10N2O4S and molecular weight 314.04 g/mol. IUPAC: 3-amino-2-benzoyl-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid.
Chemical Property Profile of Compound 7
Property Insights of Compound 7
The XLogP value of 2.101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Compound 7. The TPSA of 113.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Compound 7. Following Lipinski's Rule of Five, Compound 7 has 3 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 Compound 7?
The CAS number of Compound 7 is 439946-22-2.
What is the molecular formula of Compound 7?
The molecular formula of Compound 7 is C15H10N2O4S.
What is the molecular weight of Compound 7?
The molecular weight of Compound 7 is 314.04 g/mol.
Where can I buy Compound 7?
You can request a quote for Compound 7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compound 7?
Yes, KEHONG BIO provides custom synthesis services for Compound 7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.