3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide
TL;DR: 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide (CAS 175277-46-0) is a chemical compound with molecular formula C7H4ClF3N2S and molecular weight 239.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-(trifluoromethyl)pyridine-2-carbothioamide
Also Known As: 3-chloro-5-(trifluoromethyl)pyridine-2-carbothioamide, Maybridge1_008892, 3-Chloro-5-(trifluoromethyl)pyridine-2-thiocarboxamide, 2-Pyridinecarbothioamide,3-chloro-5-(trifluoromethyl)-, 3-chloro-5-(triluoromethyl)pyridine-2-carbothioamide
| Molecular Formula | C7H4ClF3N2S |
|---|---|
| Molecular Weight | 239.97 g/mol |
| LogP | 2.388 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.97359 |
| Heavy Atoms | 14 |
| Complexity | 377.68793 |
Chemical Identifiers
| CAS Number | 175277-46-0 |
|---|---|
| SMILES | C1=C(C=NC(=C1Cl)C(=S)N)C(F)(F)F |
Product Overview
3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide (CAS 175277-46-0), with molecular formula C7H4ClF3N2S and molecular weight 239.97 g/mol. IUPAC: 3-chloro-5-(trifluoromethyl)pyridine-2-carbothioamide.
Chemical Property Profile of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide
Property Insights of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide
The XLogP value of 2.388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide. With a topological polar surface area (TPSA) of 38.91 Ų, 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide has 1 hydrogen bond donor(s) and 2 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 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide?
The CAS number of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide is 175277-46-0.
What is the molecular formula of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide?
The molecular formula of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide is C7H4ClF3N2S.
What is the molecular weight of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide?
The molecular weight of 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide is 239.97 g/mol.
Where can I buy 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide?
You can request a quote for 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-5-(trifluoromethyl)pyridine-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.