5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine
TL;DR: 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine (CAS 7397-68-4) is a chemical compound with molecular formula C10H9F3N4O and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,2,2-trifluoroethoxy)quinazoline-2,4-diamine
Also Known As: 5-(2,2,2-trifluoroethoxy)quinazoline-2,4-diamine, DIAMINOQUINAZOLINE DER., 2-fluoro-6-thiomethylbenzonitrile, 5-(2,2,2-Trifluoro-ethoxy)-quinazoline-2,4-diamine, 2,4-diamino-5-(2,2,2-trifluoroethoxy)quinazoline
| Molecular Formula | C10H9F3N4O |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 87.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.07285 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 7397-68-4 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)OCC(F)(F)F)C(=NC(=N2)N)N |
| InChIKey | CMIRUHXLWHGPHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine (CAS 7397-68-4), with molecular formula C10H9F3N4O and molecular weight 258.07 g/mol. IUPAC: 5-(2,2,2-trifluoroethoxy)quinazoline-2,4-diamine.
Chemical Property Profile of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine
Property Insights of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine. Following Lipinski's Rule of Five, 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine has 2 hydrogen bond donor(s) and 8 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-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine?
The CAS number of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine is 7397-68-4.
What is the molecular formula of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine?
The molecular formula of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine is C10H9F3N4O.
What is the molecular weight of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine?
The molecular weight of 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine is 258.07 g/mol.
Where can I buy 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine?
You can request a quote for 5-(2,2,2-Trifluoroethoxy)quinazoline-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 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,2,2-Trifluoroethoxy)quinazoline-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.