1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone
TL;DR: 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone (CAS 831205-10-8) is a chemical compound with molecular formula C19H19ClN4O2 and molecular weight 370.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-2-methoxyethanone
Also Known As: 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone, 1-{5-[(4-chlorobenzyl)amino]-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl}-2-methoxyethanone, N-(4-chlorobenzyl)-1-(methoxyacetyl)-3-(4-methylphenyl)-1H-1,2,4-triazol-5-amine, 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-2-methoxyethanone
| Molecular Formula | C19H19ClN4O2 |
|---|---|
| Molecular Weight | 370.12 g/mol |
| LogP | 3.80562 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.11966 |
| Heavy Atoms | 26 |
| Complexity | 888.90753 |
Chemical Identifiers
| CAS Number | 831205-10-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)COC |
Product Overview
1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone (CAS 831205-10-8), with molecular formula C19H19ClN4O2 and molecular weight 370.12 g/mol. IUPAC: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-2-methoxyethanone.
Chemical Property Profile of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone
Property Insights of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone
The XLogP value of 3.80562 indicates that 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone. Following Lipinski's Rule of Five, 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone has 1 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 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone?
The CAS number of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone is 831205-10-8.
What is the molecular formula of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone?
The molecular formula of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone is C19H19ClN4O2.
What is the molecular weight of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone?
The molecular weight of 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone is 370.12 g/mol.
Where can I buy 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone?
You can request a quote for 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-((4-chlorobenzyl)amino)-3-(p-tolyl)-1H-1,2,4-triazol-1-yl)-2-methoxyethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.