![5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one structure](/static/products/879/879639-33-5.png)
5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one
TL;DR: 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one (CAS 879639-33-5) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-methoxyphenyl)ethylamino]-2H-1,2,4-triazin-3-one
Also Known As: AS-871/43475754, 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one, 5-[2-(4-methoxyphenyl)ethylamino]-2H-1,2,4-triazin-3-one, 5-{[2-(4-methoxyphenyl)ethyl]amino}-2H-1,2,4-triazin-3-one
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 0.8281 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 550.5039 |
Chemical Identifiers
| CAS Number | 879639-33-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CCNC2=NC(=O)NN=C2 |
Product Overview
5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one (CAS 879639-33-5), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: 5-[2-(4-methoxyphenyl)ethylamino]-2H-1,2,4-triazin-3-one.
Chemical Property Profile of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one
Property Insights of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one
The XLogP value of 0.8281 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one. Following Lipinski's Rule of Five, 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one has 2 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 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one?
The CAS number of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one is 879639-33-5.
What is the molecular formula of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one?
The molecular formula of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one is C12H14N4O2.
What is the molecular weight of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one?
The molecular weight of 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one is 246.11 g/mol.
Where can I buy 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one?
You can request a quote for 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-{[2-(4-methoxyphenyl)ethyl]amino}-1,2,4-triazin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.