Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate
TL;DR: Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate (CAS 41225-92-7) is a chemical compound with molecular formula C25H26ClNO9 and molecular weight 519.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate
Also Known As: Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate, 5-(p-Chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)benzofuran oxalate, 2-[[5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate, 2-Propen-1-one, 3-(4-chlorophenyl)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-, ethanedioate (1:1), RefChem:1078887
| Molecular Formula | C25H26ClNO9 |
|---|---|
| Molecular Weight | 519.13 g/mol |
| LogP | 1.3437 |
| Topological Polar Surface Area | 139.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 519.12964 |
| Heavy Atoms | 36 |
| Complexity | 1234.6436 |
Chemical Identifiers
| CAS Number | 41225-92-7 |
|---|---|
| SMILES | C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)Cl)OC)OC.C(=O)(C(=O)[O-])O |
Product Overview
Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate (CAS 41225-92-7), with molecular formula C25H26ClNO9 and molecular weight 519.13 g/mol. IUPAC: 2-[[5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate.
Chemical Property Profile of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate
Property Insights of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate
The XLogP value of 1.3437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate. The TPSA of 139.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate. Following Lipinski's Rule of Five, Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate?
The CAS number of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate is 41225-92-7.
What is the molecular formula of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate?
The molecular formula of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate is C25H26ClNO9.
What is the molecular weight of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate?
The molecular weight of Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate is 519.13 g/mol.
Where can I buy Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate?
You can request a quote for Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate?
Yes, KEHONG BIO provides custom synthesis services for Benzofuran, 5-(p-chlorocinnamoyl)-4,7-dimethoxy-6-(2-dimethylaminoethoxy)-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.