6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine
TL;DR: 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine (CAS 6961-60-0) is a chemical compound with molecular formula C12H12ClN3O and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-N-(2-ethoxyphenyl)pyrimidin-4-amine
Also Known As: 6-chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine
| Molecular Formula | C12H12ClN3O |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 47.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.0669 |
| Heavy Atoms | 17 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 6961-60-0 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC2=CC(=NC=N2)Cl |
| InChIKey | AGHOMKLQRUICRT-UHFFFAOYSA-N |
Product Overview
6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine (CAS 6961-60-0), with molecular formula C12H12ClN3O and molecular weight 249.07 g/mol. IUPAC: 6-chloro-N-(2-ethoxyphenyl)pyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine
Property Insights of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine
The XLogP value of 3.4 indicates that 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.0 Ų, 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine has 1 hydrogen bond donor(s) and 4 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-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine?
The CAS number of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine is 6961-60-0.
What is the molecular formula of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine?
The molecular formula of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine is C12H12ClN3O.
What is the molecular weight of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine?
The molecular weight of 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine is 249.07 g/mol.
Where can I buy 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine?
You can request a quote for 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-n-(2-ethoxyphenyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.