Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate
TL;DR: Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate (CAS 65954-05-4) is a chemical compound with molecular formula C11H16Cl2N4O2 and molecular weight 306.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]hexanoate
Also Known As: Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate, ethyl 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]hexanoate, 2,4-Dichloro-6-(5-ethoxycarbonylpentylamino)-s-triazine, Ethyl6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate, Ethyl 6-[(4,6-dichloro-1,3,5-triazin-2(1H)-ylidene)amino]hexanoate
| Molecular Formula | C11H16Cl2N4O2 |
|---|---|
| Molecular Weight | 306.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 306.06503 |
| Heavy Atoms | 19 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 65954-05-4 |
|---|---|
| SMILES | CCOC(=O)CCCCCNC1=NC(=NC(=N1)Cl)Cl |
| InChIKey | LEUQFDCSUWDNTF-UHFFFAOYSA-N |
Product Overview
Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate (CAS 65954-05-4), with molecular formula C11H16Cl2N4O2 and molecular weight 306.07 g/mol. IUPAC: ethyl 6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]hexanoate.
Chemical Property Profile of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate
Property Insights of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate
The XLogP value of 3.5 indicates that Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate. Following Lipinski's Rule of Five, Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate has 1 hydrogen bond donor(s) and 6 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 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate?
The CAS number of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate is 65954-05-4.
What is the molecular formula of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate?
The molecular formula of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate is C11H16Cl2N4O2.
What is the molecular weight of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate?
The molecular weight of Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate is 306.07 g/mol.
Where can I buy Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate?
You can request a quote for Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-((4,6-dichloro-1,3,5-triazin-2-yl)amino)hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.