5-(2-chlorophenyl)-1H-1,2,4-triazole
TL;DR: 5-(2-chlorophenyl)-1H-1,2,4-triazole (CAS 56015-92-0) is a chemical compound with molecular formula C8H6ClN3 and molecular weight 179.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-chlorophenyl)-1H-1,2,4-triazole
Also Known As: 5-(2-chlorophenyl)-1H-1,2,4-triazole, ciglitazone, 3-(2-Chlorophenyl)-4H-1,2,4-triazole, 5- -1H-1,2,4-TRIAZOLE, 3-(2-chlorophenyl)-4~{H}-1,2,4-triazole
| Molecular Formula | C8H6ClN3 |
|---|---|
| Molecular Weight | 179.03 g/mol |
| LogP | 2.1251 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.02502 |
| Heavy Atoms | 12 |
| Complexity | 369.55182 |
Chemical Identifiers
| CAS Number | 56015-92-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC=NN2)Cl |
Product Overview
5-(2-chlorophenyl)-1H-1,2,4-triazole (CAS 56015-92-0), with molecular formula C8H6ClN3 and molecular weight 179.03 g/mol. IUPAC: 5-(2-chlorophenyl)-1H-1,2,4-triazole.
Chemical Property Profile of 5-(2-chlorophenyl)-1H-1,2,4-triazole
Property Insights of 5-(2-chlorophenyl)-1H-1,2,4-triazole
The XLogP value of 2.1251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-chlorophenyl)-1H-1,2,4-triazole. With a topological polar surface area (TPSA) of 41.57 Ų, 5-(2-chlorophenyl)-1H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-chlorophenyl)-1H-1,2,4-triazole 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 5-(2-chlorophenyl)-1H-1,2,4-triazole?
The CAS number of 5-(2-chlorophenyl)-1H-1,2,4-triazole is 56015-92-0.
What is the molecular formula of 5-(2-chlorophenyl)-1H-1,2,4-triazole?
The molecular formula of 5-(2-chlorophenyl)-1H-1,2,4-triazole is C8H6ClN3.
What is the molecular weight of 5-(2-chlorophenyl)-1H-1,2,4-triazole?
The molecular weight of 5-(2-chlorophenyl)-1H-1,2,4-triazole is 179.03 g/mol.
Where can I buy 5-(2-chlorophenyl)-1H-1,2,4-triazole?
You can request a quote for 5-(2-chlorophenyl)-1H-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-chlorophenyl)-1H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-chlorophenyl)-1H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.