2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid
TL;DR: 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid (CAS 303149-99-7) is a chemical compound with molecular formula C12H6ClF3N2O2S and molecular weight 333.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]pyridine-3-carboxylic acid
Also Known As: 2-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-sulfanyl}nicotinic acid, 9572AD, 2-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)thio)nicotinic acid, 2-{[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]thio}nicotinic acid, 2-([3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl)nicotinic acid
| Molecular Formula | C12H6ClF3N2O2S |
|---|---|
| Molecular Weight | 333.98 g/mol |
| LogP | 3.9982 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.97906 |
| Heavy Atoms | 21 |
| Complexity | 694.443 |
Chemical Identifiers
| CAS Number | 303149-99-7 |
|---|---|
| SMILES | C1=CC(=C(N=C1)SC2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)O |
Product Overview
2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid (CAS 303149-99-7), with molecular formula C12H6ClF3N2O2S and molecular weight 333.98 g/mol. IUPAC: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]pyridine-3-carboxylic acid.
Chemical Property Profile of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid
Property Insights of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid
The XLogP value of 3.9982 indicates that 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid. Following Lipinski's Rule of Five, 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid 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-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid?
The CAS number of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid is 303149-99-7.
What is the molecular formula of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid?
The molecular formula of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid is C12H6ClF3N2O2S.
What is the molecular weight of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid?
The molecular weight of 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid is 333.98 g/mol.
Where can I buy 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid?
You can request a quote for 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)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-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-5-(Trifluoromethyl)-2-Pyridylthio)Pyridine-3-Carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.