![2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine structure](/static/products/401/401596-20-1.png)
2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine
TL;DR: 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine (CAS 401596-20-1) is a chemical compound with molecular formula C13H10FN3S and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-fluorophenyl)methylsulfanyl]-1H-imidazo[4,5-b]pyridine
Also Known As: BAS 05510737, 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine, 2-((3-fluorobenzyl)thio)-3H-imidazo[4,5-b]pyridine, 2-[(3-fluorophenyl)methylthio]imidazo[5,4-b]pyridine, 3H-Imidazo[4,5-b]pyridine, 2-(3-fluorobenzylthio)-
| Molecular Formula | C13H10FN3S |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.05795 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 401596-20-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)CSC2=NC3=C(N2)C=CC=N3 |
| InChIKey | JAXBGCZETGOOMH-UHFFFAOYSA-N |
Product Overview
2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine (CAS 401596-20-1), with molecular formula C13H10FN3S and molecular weight 259.06 g/mol. IUPAC: 2-[(3-fluorophenyl)methylsulfanyl]-1H-imidazo[4,5-b]pyridine.
Chemical Property Profile of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine
Property Insights of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine
The XLogP value of 3.2 indicates that 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine. Following Lipinski's Rule of Five, 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine 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 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine?
The CAS number of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine is 401596-20-1.
What is the molecular formula of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine?
The molecular formula of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine is C13H10FN3S.
What is the molecular weight of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine?
The molecular weight of 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine is 259.06 g/mol.
Where can I buy 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine?
You can request a quote for 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Fluoro-benzylsulfanyl)-3H-imidazo[4,5-b]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.