5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine
TL;DR: 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine (CAS 3652-17-3) is a chemical compound with molecular formula C7H7N5 and molecular weight 161.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-pyridin-4-yl-1H-1,2,4-triazol-3-amine
Also Known As: 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine, 3-(pyridin-4-yl)-1H-1,2,4-triazol-5-amine, 3-(4-pyridinyl)-1H-1,2,4-triazol-5-amine, 5-pyridin-4-yl-1H-1,2,4-triazol-3-amine, 1H-1,2,4-Triazol-3-amine, 5-(4-pyridinyl)-
| Molecular Formula | C7H7N5 |
|---|---|
| Molecular Weight | 161.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 80.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.07014 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 3652-17-3 |
|---|---|
| SMILES | C1=CN=CC=C1C2=NC(=NN2)N |
| InChIKey | PHYOJNNPPUPKEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine (CAS 3652-17-3), with molecular formula C7H7N5 and molecular weight 161.07 g/mol. IUPAC: 5-pyridin-4-yl-1H-1,2,4-triazol-3-amine.
Chemical Property Profile of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine
Property Insights of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine. Following Lipinski's Rule of Five, 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine has 2 hydrogen bond donor(s) and 4 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-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine?
The CAS number of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine is 3652-17-3.
What is the molecular formula of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine?
The molecular formula of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine is C7H7N5.
What is the molecular weight of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine?
The molecular weight of 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine is 161.07 g/mol.
Where can I buy 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine?
You can request a quote for 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-(pyridin-4-yl)-4H-1,2,4-triazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.