(2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one
TL;DR: (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one (CAS 402783-71-5) is a chemical compound with molecular formula C18H15Cl2NO2 and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one
Also Known As: (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one, 2-[[5-(3,4-dichlorophenyl)-2-furyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one
| Molecular Formula | C18H15Cl2NO2 |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 4.889 |
| Topological Polar Surface Area | 33.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.04797 |
| Heavy Atoms | 23 |
| Complexity | 801.10297 |
Chemical Identifiers
| CAS Number | 402783-71-5 |
|---|---|
| SMILES | C1CN\2CCC1C(=O)/C2=C\C3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl |
Product Overview
(2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one (CAS 402783-71-5), with molecular formula C18H15Cl2NO2 and molecular weight 347.05 g/mol. IUPAC: (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one.
Chemical Property Profile of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one
Property Insights of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one
The XLogP value of 4.889 indicates that (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.45 Ų, (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one has 0 hydrogen bond donor(s) and 3 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 (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The CAS number of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one is 402783-71-5.
What is the molecular formula of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The molecular formula of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one is C18H15Cl2NO2.
What is the molecular weight of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The molecular weight of (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one is 347.05 g/mol.
Where can I buy (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one?
You can request a quote for (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-1-azabicyclo[2.2.2]octan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.