(3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one
TL;DR: (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one (CAS 6028-23-5) is a chemical compound with molecular formula C18H13NO5 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one
Also Known As: BIM-0041137.P001, 5-(4-methoxyphenyl)-3-(4-nitrobenzylidene)-2(3H)-furanone, (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one, 3-(4-Nitrobenzylidene)-5-(4-methoxyphenyl)-2,3-dihydrofuran-2-one, (3E)-5-(4-Methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2(3H)-one
| Molecular Formula | C18H13NO5 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 3.5847 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.07938 |
| Heavy Atoms | 24 |
| Complexity | 847.9828 |
Chemical Identifiers
| CAS Number | 6028-23-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)O2 |
Product Overview
(3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one (CAS 6028-23-5), with molecular formula C18H13NO5 and molecular weight 323.08 g/mol. IUPAC: (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one.
Chemical Property Profile of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one
Property Insights of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one
The XLogP value of 3.5847 indicates that (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one. Following Lipinski's Rule of Five, (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one has 0 hydrogen bond donor(s) and 5 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 (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one?
The CAS number of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one is 6028-23-5.
What is the molecular formula of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one?
The molecular formula of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one is C18H13NO5.
What is the molecular weight of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one?
The molecular weight of (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one is 323.08 g/mol.
Where can I buy (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one?
You can request a quote for (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]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 (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-5-(4-methoxyphenyl)-3-[(4-nitrophenyl)methylidene]furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.