ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate
TL;DR: ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate (CAS 827002-53-9) is a chemical compound with molecular formula C18H25N7O3 and molecular weight 387.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl]piperazine-1-carboxylate
Also Known As: ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate, ethyl 4-({4-amino-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl}methyl)piperazine-1-carboxylate, ethyl 4-[[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl]piperazine-1-carboxylate, 4-[4-Amino-6-(4-methoxy-phenylamino)-[1,3,5]triazin-2-ylmethyl]-piperazine-1-carboxylic acid ethyl ester, ethyl 4-((4-amino-6-((4-methoxyphenyl)amino)-1,3,5-triazin-2-yl)methyl)piperazine-1-carboxylate
| Molecular Formula | C18H25N7O3 |
|---|---|
| Molecular Weight | 387.20 g/mol |
| LogP | 1.4801 |
| Topological Polar Surface Area | 118.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.20187 |
| Heavy Atoms | 28 |
| Complexity | 792.2663 |
Chemical Identifiers
| CAS Number | 827002-53-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC2=NC(=NC(=N2)NC3=CC=C(C=C3)OC)N |
Product Overview
ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate (CAS 827002-53-9), with molecular formula C18H25N7O3 and molecular weight 387.20 g/mol. IUPAC: ethyl 4-[[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate
Property Insights of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate
The XLogP value of 1.4801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate. The TPSA of 118.73 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate. Following Lipinski's Rule of Five, ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate has 2 hydrogen bond donor(s) and 9 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 ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate?
The CAS number of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate is 827002-53-9.
What is the molecular formula of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate?
The molecular formula of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate is C18H25N7O3.
What is the molecular weight of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate?
The molecular weight of ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate is 387.20 g/mol.
Where can I buy ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate?
You can request a quote for ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-((4-amino-6-((4-(methyloxy)phenyl)amino)-1,3,5-triazin-2-yl)methyl)-1-piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.