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Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate structure
Fine Chemical

Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate

TL;DR: Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate (CAS 500196-91-8) is a chemical compound with molecular formula C25H22N2O6 and molecular weight 446.1478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

bis(prop-2-enyl) 2,6-diamino-4-(4-methylphenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate

Also Known As: bis(prop-2-enyl) 2,6-diamino-4-(4-methylphenyl)furo[2,3-f][1]benzofuran-3,7-dicarboxylate, DIALLYL 2,6-DIAMINO-4-(4-METHYLPHENYL)FURO[2,3-F][1]BENZOFURAN-3,7-DICARBOXYLATE, diallyl 2,6-diamino-4-(p-tolyl)benzo[1,2-b:4,5-b']difuran-3,7-dicarboxylate, diprop-2-en-1-yl 2,6-diamino-4-(4-methylphenyl)benzo[1,2-b:4,5-b']difuran-3,7-dicarboxylate

CAS Number
500196-91-8
Molecular Formula
C25H22N2O6
Molecular Weight
446.1478 g/mol
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Technical Specifications

Molecular FormulaC25H22N2O6
Molecular Weight446.1478 g/mol
XLogP6.1
Topological Polar Surface Area (TPSA)131.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds9
Exact Mass446.1478 Da
Heavy Atoms33
Complexity751.0
SMILESCC1=CC=C(C=C1)C2=C3C(=CC4=C2C(=C(O4)N)C(=O)OCC=C)C(=C(O3)N)C(=O)OCC=C
InChIKeyKVIMBKUZZUSEOD-UHFFFAOYSA-N

Chemical Property Profile of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate

XLogP
6.1
TPSA (Topological Polar Surface Area)
131.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
9
Heavy Atoms
33
Complexity
751.0
Exact Mass
446.1478
Monoisotopic Mass
446.1478
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate

The XLogP value of 6.1 indicates that Diallyl 2,6-diamino-4-(4-methylphenyl)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 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate. Following Lipinski's Rule of Five, Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate?

The CAS number of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate is 500196-91-8.

What is the molecular formula of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate?

The molecular formula of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate is C25H22N2O6.

What is the molecular weight of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate?

The molecular weight of Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate is 446.1478 g/mol.

Where can I buy Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate?

You can request a quote for Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate?

Yes, CoreyChem provides custom synthesis services for Diallyl 2,6-diamino-4-(4-methylphenyl)furo[2,3-F][1]benzofuran-3,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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