Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-
TL;DR: Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- (CAS 90183-18-9) is a chemical compound with molecular formula C14H17FN2O and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-fluorobenzamide
Also Known As: N-(3-Quinuclidinyl)-2-fluorobenzamide, 2-fluoro-N-(quinuclidin-3-yl)benzamide, Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-, J1.165.325A, N-(1-azabicyclo[2.2.2]octan-3-yl)-2-fluorobenzamide
| Molecular Formula | C14H17FN2O |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 1.6497 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.13249 |
| Heavy Atoms | 18 |
| Complexity | 454.86215 |
Chemical Identifiers
| CAS Number | 90183-18-9 |
|---|---|
| SMILES | C1CN2CCC1C(C2)NC(=O)C3=CC=CC=C3F |
Product Overview
Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- (CAS 90183-18-9), with molecular formula C14H17FN2O and molecular weight 248.13 g/mol. IUPAC: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-fluorobenzamide.
Chemical Property Profile of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-
Property Insights of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-
The XLogP value of 1.6497 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-. With a topological polar surface area (TPSA) of 32.34 Ų, Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- has 1 hydrogen bond donor(s) and 2 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 Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-?
The CAS number of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- is 90183-18-9.
What is the molecular formula of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-?
The molecular formula of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- is C14H17FN2O.
What is the molecular weight of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-?
The molecular weight of Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- is 248.13 g/mol.
Where can I buy Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-?
You can request a quote for Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, N-1-azabicyclo[2.2.2]oct-3-yl-2-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.