6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine
TL;DR: 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine (CAS 105704-31-2) is a chemical compound with molecular formula C12H14ClN5O and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(chloromethyl)-2-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine
Also Known As: 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine, 6-(chloromethyl)-N2-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine, 1,3,5-Triazine-2,4-diamine, 6-(chloromethyl)-N-(4-ethoxyphenyl)-, 6-(chloromethyl)-2-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine, BRD-K05937365-001-04-4
| Molecular Formula | C12H14ClN5O |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 2.3349 |
| Topological Polar Surface Area | 85.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.08868 |
| Heavy Atoms | 19 |
| Complexity | 546.31604 |
Chemical Identifiers
| CAS Number | 105704-31-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CCl |
Product Overview
6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine (CAS 105704-31-2), with molecular formula C12H14ClN5O and molecular weight 279.09 g/mol. IUPAC: 6-(chloromethyl)-2-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine
Property Insights of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine
The XLogP value of 2.3349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine. The TPSA of 85.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine has 2 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 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine?
The CAS number of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine is 105704-31-2.
What is the molecular formula of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine?
The molecular formula of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine is C12H14ClN5O.
What is the molecular weight of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine?
The molecular weight of 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine is 279.09 g/mol.
Where can I buy 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine?
You can request a quote for 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-(chloromethyl)-N-(4-ethoxyphenyl)-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.