AF-615/25002800
TL;DR: AF-615/25002800 (CAS 66533-95-7) is a chemical compound with molecular formula C12H10N2O2S and molecular weight 246.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzylsulfanylpyrazine-2-carboxylic acid
Also Known As: 6-(benzylsulfanyl)pyrazine-2-carboxylic acid, 6-benzylsulfanylpyrazine-2-carboxylic acid, 6-(Benzylthio)pyrazine-2-carboxylic acid, 6-[BENZYLTHIO]-PYRAZINECARBOXYLIC ACID, 6-benzylsulfanyl-pyrazine-2-carboxylic acid
| Molecular Formula | C12H10N2O2S |
|---|---|
| Molecular Weight | 246.05 g/mol |
| LogP | 2.4671 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.0463 |
| Heavy Atoms | 17 |
| Complexity | 516.9239 |
Chemical Identifiers
| CAS Number | 66533-95-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC(=CN=C2)C(=O)O |
Product Overview
AF-615/25002800 (CAS 66533-95-7), with molecular formula C12H10N2O2S and molecular weight 246.05 g/mol. IUPAC: 6-benzylsulfanylpyrazine-2-carboxylic acid.
Chemical Property Profile of AF-615/25002800
Property Insights of AF-615/25002800
The XLogP value of 2.4671 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-615/25002800. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-615/25002800. Following Lipinski's Rule of Five, AF-615/25002800 has 1 hydrogen bond donor(s) and 4 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 AF-615/25002800?
The CAS number of AF-615/25002800 is 66533-95-7.
What is the molecular formula of AF-615/25002800?
The molecular formula of AF-615/25002800 is C12H10N2O2S.
What is the molecular weight of AF-615/25002800?
The molecular weight of AF-615/25002800 is 246.05 g/mol.
Where can I buy AF-615/25002800?
You can request a quote for AF-615/25002800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-615/25002800?
Yes, KEHONG BIO provides custom synthesis services for AF-615/25002800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.