![2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine structure](/static/products/876/87633-57-6.png)
2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine
TL;DR: 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine (CAS 87633-57-6) is a chemical compound with molecular formula C9H8N6 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-1,2,4-triazol-3-amine
Also Known As: 1-(1H-1,3-benzodiazol-2-yl)-1H-1,2,4-triazol-5-amine, 2-(1H-benzimidazol-2-yl)-1,2,4-triazol-3-amine, 2-(1H-BENZOIMIDAZOL-2-YL)-2H-[1,2,4]TRIAZOL-3-YLAMINE, 2-(3-Amino-1,2,4-triazol-2-yl)benzimidazol, 1H-1,2,4-Triazol-5-amine, 1-(1H-benzimidazol-2-yl)-
| Molecular Formula | C9H8N6 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 85.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.08104 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 87633-57-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)N3C(=NC=N3)N |
| InChIKey | VCGAIPSUNFKDPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine (CAS 87633-57-6), with molecular formula C9H8N6 and molecular weight 200.08 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-1,2,4-triazol-3-amine.
Chemical Property Profile of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine
Property Insights of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine. Following Lipinski's Rule of Five, 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine 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 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine?
The CAS number of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine is 87633-57-6.
What is the molecular formula of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine?
The molecular formula of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine is C9H8N6.
What is the molecular weight of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine?
The molecular weight of 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine is 200.08 g/mol.
Where can I buy 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine?
You can request a quote for 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-Benzoimidazol-2-YL)-2H-[1,2,4]triazol-3-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.