Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate
TL;DR: Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate (CAS 447429-67-6) is a chemical compound with molecular formula C22H19FN2O6 and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate
Also Known As: A2560/0109044, diethyl 2,6-diamino-4-(4-fluorophenyl)benzo[1,2-b:4,5-b']difuran-3,7-dicarboxylate, diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate, ethyl 2,6-diamino-7-(ethoxycarbonyl)-8-(4-fluorophenyl)furano[2',3'-4,5]benzo[ b]furan-3-carboxylate
| Molecular Formula | C22H19FN2O6 |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 4.5029 |
| Topological Polar Surface Area | 130.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.1227 |
| Heavy Atoms | 31 |
| Complexity | 1320.0199 |
Chemical Identifiers
| CAS Number | 447429-67-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C3=C(C=C12)OC(=C3C(=O)OCC)N)C4=CC=C(C=C4)F)N |
Product Overview
Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate (CAS 447429-67-6), with molecular formula C22H19FN2O6 and molecular weight 426.12 g/mol. IUPAC: diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate.
Chemical Property Profile of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate
Property Insights of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate
The XLogP value of 4.5029 indicates that Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate 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 Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate?
The CAS number of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate is 447429-67-6.
What is the molecular formula of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate?
The molecular formula of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate is C22H19FN2O6.
What is the molecular weight of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate?
The molecular weight of Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate is 426.12 g/mol.
Where can I buy Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate?
You can request a quote for Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2,6-diamino-4-(4-fluorophenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.