![3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine structure](/static/products/3384/338407-41-3.webp)
3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine
TL;DR: 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine (CAS 338407-41-3) is a chemical compound with molecular formula C12H7ClF3N5 and molecular weight 313.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2-[2-(1H-1,2,4-triazol-5-yl)pyrrol-1-yl]-5-(trifluoromethyl)pyridine
Also Known As: 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine, 3-chloro-2-[2-(1H-1,2,4-triazol-5-yl)pyrrol-1-yl]-5-(trifluoromethyl)pyridine, 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)pyrrol-1-yl]-5-(trifluoromethyl)pyridine, Pyridine, 3-chloro-2-[2-(1H-1,2,4-triazol-5-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)-, C12H7ClF3N5
| Molecular Formula | C12H7ClF3N5 |
|---|---|
| Molecular Weight | 313.03 g/mol |
| LogP | 3.3296 |
| Topological Polar Surface Area | 59.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.0342 |
| Heavy Atoms | 21 |
| Complexity | 763.54846 |
Chemical Identifiers
| CAS Number | 338407-41-3 |
|---|---|
| SMILES | C1=CN(C(=C1)C2=NC=NN2)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine (CAS 338407-41-3), with molecular formula C12H7ClF3N5 and molecular weight 313.03 g/mol. IUPAC: 3-chloro-2-[2-(1H-1,2,4-triazol-5-yl)pyrrol-1-yl]-5-(trifluoromethyl)pyridine.
Chemical Property Profile of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine
Property Insights of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine
The XLogP value of 3.3296 indicates that 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.39 Ų, 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine 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 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine?
The CAS number of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine is 338407-41-3.
What is the molecular formula of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine?
The molecular formula of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine is C12H7ClF3N5.
What is the molecular weight of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine?
The molecular weight of 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine is 313.03 g/mol.
Where can I buy 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine?
You can request a quote for 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-2-[2-(1H-1,2,4-triazol-3-yl)-1H-pyrrol-1-yl]-5-(trifluoromethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.