3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine (CAS 52868-20-9) is a chemical compound with molecular formula C14H14N6 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-bis(3-aminophenyl)-1,2,4-triazol-4-amine
Also Known As: 3,5-bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine, 3,5-bis(3-aminophenyl)-1,2,4-triazol-4-amine, J1.086.622G, bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine, 3,5-bis(3-amino-phenyl)-4-amino-1,2,4-triazole
| Molecular Formula | C14H14N6 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 1.4903 |
| Topological Polar Surface Area | 108.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.128 |
| Heavy Atoms | 20 |
| Complexity | 698.8606 |
Chemical Identifiers
| CAS Number | 52868-20-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N)C2=NN=C(N2N)C3=CC(=CC=C3)N |
Product Overview
3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine (CAS 52868-20-9), with molecular formula C14H14N6 and molecular weight 266.13 g/mol. IUPAC: 3,5-bis(3-aminophenyl)-1,2,4-triazol-4-amine.
Chemical Property Profile of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 1.4903 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine. The TPSA of 108.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine has 3 hydrogen bond donor(s) and 5 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 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine is 52868-20-9.
What is the molecular formula of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine is C14H14N6.
What is the molecular weight of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine is 266.13 g/mol.
Where can I buy 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(3-aminophenyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.