![2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid structure](/static/products/955/955-52-2.png)
2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid
TL;DR: 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid (CAS 955-52-2) is a chemical compound with molecular formula C12H8BrNO2S and molecular weight 308.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)sulfanylpyridine-3-carboxylic acid
Also Known As: 2-[(4-bromophenyl)sulfanyl]pyridine-3-carboxylic acid, 1-(Diethoxymethyl)imidazole, 2-[(4-bromophenyl)thio]nicotinic acid, 2-((4-Bromophenyl)thio)nicotinic acid, 2-(4-bromophenyl)sulfanylpyridine-3-carboxylic Acid
| Molecular Formula | C12H8BrNO2S |
|---|---|
| Molecular Weight | 308.95 g/mol |
| LogP | 3.6935 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.94592 |
| Heavy Atoms | 17 |
| Complexity | 542.45685 |
Chemical Identifiers
| CAS Number | 955-52-2 |
|---|---|
| SMILES | C1=CC(=C(N=C1)SC2=CC=C(C=C2)Br)C(=O)O |
Product Overview
2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid (CAS 955-52-2), with molecular formula C12H8BrNO2S and molecular weight 308.95 g/mol. IUPAC: 2-(4-bromophenyl)sulfanylpyridine-3-carboxylic acid.
Chemical Property Profile of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid
Property Insights of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid
The XLogP value of 3.6935 indicates that 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.19 Ų, 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid has 1 hydrogen bond donor(s) and 3 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-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid?
The CAS number of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid is 955-52-2.
What is the molecular formula of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid?
The molecular formula of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid is C12H8BrNO2S.
What is the molecular weight of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid?
The molecular weight of 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid is 308.95 g/mol.
Where can I buy 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid?
You can request a quote for 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Bromophenyl)sulfanyl]pyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.