(3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one
TL;DR: (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one (CAS 5668-22-4) is a chemical compound with molecular formula C18H11BrO4 and molecular weight 369.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one
Also Known As: BIM-0027417.P001, 3-(1,3-benzodioxol-5-ylmethylene)-5-(4-bromophenyl)-2(3H)-furanone, (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one, (3Z)-3-[(2H-1,3-Benzodioxol-5-yl)methylidene]-5-(4-bromophenyl)furan-2(3H)-one, 3-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethylene)-5-(4-bromophenyl)furan-2-one
| Molecular Formula | C18H11BrO4 |
|---|---|
| Molecular Weight | 369.98 g/mol |
| LogP | 4.1591 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.98407 |
| Heavy Atoms | 23 |
| Complexity | 849.8254 |
Chemical Identifiers
| CAS Number | 5668-22-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C\3/C=C(OC3=O)C4=CC=C(C=C4)Br |
Product Overview
(3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one (CAS 5668-22-4), with molecular formula C18H11BrO4 and molecular weight 369.98 g/mol. IUPAC: (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one.
Chemical Property Profile of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one
Property Insights of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one
The XLogP value of 4.1591 indicates that (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one has 0 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 (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one?
The CAS number of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one is 5668-22-4.
What is the molecular formula of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one?
The molecular formula of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one is C18H11BrO4.
What is the molecular weight of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one?
The molecular weight of (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one is 369.98 g/mol.
Where can I buy (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one?
You can request a quote for (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-bromophenyl)furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.