N-phenyl-1H-1,2,4-triazol-5-amine
TL;DR: N-phenyl-1H-1,2,4-triazol-5-amine (CAS 2433-53-6) is a chemical compound with molecular formula C8H8N4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-1H-1,2,4-triazol-5-amine
Also Known As: N-phenyl-1H-1,2,4-triazol-5-amine, Bionet2_000134, 3-Anilino-2H-1,2,4-triazole, phenyl-(1H-[1,2,4]triazol-3-yl)-amine, (1h-1,2,4-triazol-3-yl)aniline
| Molecular Formula | C8H8N4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.07489 |
| Heavy Atoms | 12 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 2433-53-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC=NN2 |
| InChIKey | IDAXEDQVCSLSEM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-phenyl-1H-1,2,4-triazol-5-amine (CAS 2433-53-6), with molecular formula C8H8N4 and molecular weight 160.07 g/mol. IUPAC: N-phenyl-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of N-phenyl-1H-1,2,4-triazol-5-amine
Property Insights of N-phenyl-1H-1,2,4-triazol-5-amine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-phenyl-1H-1,2,4-triazol-5-amine. With a topological polar surface area (TPSA) of 53.6 Ų, N-phenyl-1H-1,2,4-triazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenyl-1H-1,2,4-triazol-5-amine has 2 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 N-phenyl-1H-1,2,4-triazol-5-amine?
The CAS number of N-phenyl-1H-1,2,4-triazol-5-amine is 2433-53-6.
What is the molecular formula of N-phenyl-1H-1,2,4-triazol-5-amine?
The molecular formula of N-phenyl-1H-1,2,4-triazol-5-amine is C8H8N4.
What is the molecular weight of N-phenyl-1H-1,2,4-triazol-5-amine?
The molecular weight of N-phenyl-1H-1,2,4-triazol-5-amine is 160.07 g/mol.
Where can I buy N-phenyl-1H-1,2,4-triazol-5-amine?
You can request a quote for N-phenyl-1H-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenyl-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-phenyl-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.