2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine
TL;DR: 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine (CAS 861211-53-2) is a chemical compound with molecular formula C8H7ClN4 and molecular weight 194.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-(1,2,4-triazol-1-ylmethyl)pyridine
Also Known As: 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine, 2-chloro-5-[(1H-1,2,4-triazol-1-yl)methyl]pyridine, 2-chloro-5-(1,2,4-triazol-1-ylmethyl)pyridine
| Molecular Formula | C8H7ClN4 |
|---|---|
| Molecular Weight | 194.04 g/mol |
| LogP | 1.3748 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.03592 |
| Heavy Atoms | 13 |
| Complexity | 367.55237 |
Chemical Identifiers
| CAS Number | 861211-53-2 |
|---|---|
| SMILES | C1=CC(=NC=C1CN2C=NC=N2)Cl |
Product Overview
2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine (CAS 861211-53-2), with molecular formula C8H7ClN4 and molecular weight 194.04 g/mol. IUPAC: 2-chloro-5-(1,2,4-triazol-1-ylmethyl)pyridine.
Chemical Property Profile of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine
Property Insights of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine
The XLogP value of 1.3748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine. With a topological polar surface area (TPSA) of 43.6 Ų, 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine has 0 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-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine?
The CAS number of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine is 861211-53-2.
What is the molecular formula of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine?
The molecular formula of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine is C8H7ClN4.
What is the molecular weight of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine?
The molecular weight of 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine is 194.04 g/mol.
Where can I buy 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine?
You can request a quote for 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-5-(1H-1,2,4-triazol-1-ylmethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.