![6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine structure](/static/products/5212/52128-19-5.webp)
6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine
TL;DR: 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine (CAS 52128-19-5) is a chemical compound with molecular formula C16H13ClF3N5 and molecular weight 367.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine
Also Known As: 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2, 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine, 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine
| Molecular Formula | C16H13ClF3N5 |
|---|---|
| Molecular Weight | 367.08 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.08115 |
| Heavy Atoms | 25 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 52128-19-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1CNC3=CC(=C(C=C3)Cl)C(F)(F)F)C(=NC(=N2)N)N |
| InChIKey | MWQJOMLECONZOL-UHFFFAOYSA-N |
Product Overview
6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine (CAS 52128-19-5), with molecular formula C16H13ClF3N5 and molecular weight 367.08 g/mol. IUPAC: 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine.
Chemical Property Profile of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine
Property Insights of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine
The XLogP value of 3.8 indicates that 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine. Following Lipinski's Rule of Five, 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine has 3 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 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine?
The CAS number of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine is 52128-19-5.
What is the molecular formula of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine?
The molecular formula of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine is C16H13ClF3N5.
What is the molecular weight of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine?
The molecular weight of 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine is 367.08 g/mol.
Where can I buy 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine?
You can request a quote for 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}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 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.