4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one
TL;DR: 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one (CAS 329070-91-9) is a chemical compound with molecular formula C17H11BrO4 and molecular weight 357.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]oxolane-2,3-dione
Also Known As: BAS 00732784, AB00096771-01, 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one, 4-Benzoyl-5-(4-bromo-phenyl)-3-hydroxy-5H-furan-2-one, 4-benzoyl-5-(4-bromophenyl)-3-hydroxy-2,5-dihydrofuran-2-one
| Molecular Formula | C17H11BrO4 |
|---|---|
| Molecular Weight | 357.98 g/mol |
| LogP | 3.5854 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.98407 |
| Heavy Atoms | 22 |
| Complexity | 763.00574 |
Chemical Identifiers
| CAS Number | 329070-91-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(OC(=O)C2=O)C3=CC=C(C=C3)Br)/O |
Product Overview
4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one (CAS 329070-91-9), with molecular formula C17H11BrO4 and molecular weight 357.98 g/mol. IUPAC: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]oxolane-2,3-dione.
Chemical Property Profile of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one
Property Insights of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one
The XLogP value of 3.5854 indicates that 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one. Following Lipinski's Rule of Five, 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one has 1 hydrogen bond donor(s) and 4 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 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one?
The CAS number of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one is 329070-91-9.
What is the molecular formula of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one?
The molecular formula of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one is C17H11BrO4.
What is the molecular weight of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one?
The molecular weight of 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one is 357.98 g/mol.
Where can I buy 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one?
You can request a quote for 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-5-(4-bromophenyl)-3-hydroxyfuran-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.