3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate
TL;DR: 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate (CAS 401463-99-8) is a chemical compound with molecular formula C25H16O5 and molecular weight 396.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzyl-2-oxochromen-4-yl) 1-benzofuran-2-carboxylate
Also Known As: 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate, (3-benzyl-2-oxochromen-4-yl) 1-benzofuran-2-carboxylate, 3-benzyl-2-oxo-2H-chromen-4-yl benzofuran-2-carboxylate
| Molecular Formula | C25H16O5 |
|---|---|
| Molecular Weight | 396.10 g/mol |
| LogP | 5.3492 |
| Topological Polar Surface Area | 69.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.09976 |
| Heavy Atoms | 30 |
| Complexity | 1393.7217 |
Chemical Identifiers
| CAS Number | 401463-99-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3OC2=O)OC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate (CAS 401463-99-8), with molecular formula C25H16O5 and molecular weight 396.10 g/mol. IUPAC: (3-benzyl-2-oxochromen-4-yl) 1-benzofuran-2-carboxylate.
Chemical Property Profile of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate
Property Insights of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate
The XLogP value of 5.3492 indicates that 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate. Following Lipinski's Rule of Five, 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate?
The CAS number of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate is 401463-99-8.
What is the molecular formula of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate?
The molecular formula of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate is C25H16O5.
What is the molecular weight of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate?
The molecular weight of 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate is 396.10 g/mol.
Where can I buy 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate?
You can request a quote for 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-2-oxo-2H-chromen-4-yl 1-benzofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.