3-(Pyridine-2-yl)-5-trifluoromethylpyrazole
TL;DR: 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole (CAS 733740-86-8) is a chemical compound with molecular formula C9H6F3N3 and molecular weight 213.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine
Also Known As: 2-(5-(Trifluoromethyl)-1H-pyrazol-3-yl)pyridine, 2-[5-(Trifluoromethyl)-1H-pyrazol-3-yl]pyridine, 3-(pyridine-2-yl)-5-trifluoromethylpyrazole, 2-(3-(Trifluoromethyl)-1H-pyrazol-5-yl)pyridine, 3-trifluoromethyl-5(2-pyridyl)pyrazole
| Molecular Formula | C9H6F3N3 |
|---|---|
| Molecular Weight | 213.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.05138 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 733740-86-8 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NNC(=C2)C(F)(F)F |
| InChIKey | DUXRDJNQKDYVNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Pyridine-2-yl)-5-trifluoromethylpyrazole (CAS 733740-86-8), with molecular formula C9H6F3N3 and molecular weight 213.05 g/mol. IUPAC: 2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine.
Chemical Property Profile of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole
Property Insights of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole. With a topological polar surface area (TPSA) of 41.6 Ų, 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole has 1 hydrogen bond donor(s) and 5 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-(Pyridine-2-yl)-5-trifluoromethylpyrazole?
The CAS number of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole is 733740-86-8.
What is the molecular formula of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole?
The molecular formula of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole is C9H6F3N3.
What is the molecular weight of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole?
The molecular weight of 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole is 213.05 g/mol.
Where can I buy 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole?
You can request a quote for 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(Pyridine-2-yl)-5-trifluoromethylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.