N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine
TL;DR: N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine (CAS 892606-07-4) is a chemical compound with molecular formula C10H12N4 and molecular weight 188.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-methylphenyl)methyl]-1,2,4-triazol-4-amine
Also Known As: N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine, N-[(2-methylphenyl)methyl]-1,2,4-triazol-4-amine, N-(2-methylbenzyl)-N-(4H-1,2,4-triazol-4-yl)amine, N-[(2-methylphenyl)methyl]-4H-1,2,4-triazol-4-amine
| Molecular Formula | C10H12N4 |
|---|---|
| Molecular Weight | 188.11 g/mol |
| LogP | 1.33022 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.1062 |
| Heavy Atoms | 14 |
| Complexity | 394.26407 |
Chemical Identifiers
| CAS Number | 892606-07-4 |
|---|---|
| SMILES | CC1=CC=CC=C1CNN2C=NN=C2 |
Product Overview
N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine (CAS 892606-07-4), with molecular formula C10H12N4 and molecular weight 188.11 g/mol. IUPAC: N-[(2-methylphenyl)methyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine
Property Insights of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 1.33022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 42.74 Ų, N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine has 1 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-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine?
The CAS number of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine is 892606-07-4.
What is the molecular formula of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine is C10H12N4.
What is the molecular weight of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine is 188.11 g/mol.
Where can I buy N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for N-(2-Methylbenzyl)-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 N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methylbenzyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.