2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-
TL;DR: 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- (CAS 57661-47-9) is a chemical compound with molecular formula C16H20FNO and molecular weight 261.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl]-(4-fluorophenyl)methanone
Also Known As: KST-1A6322, 2-axial-(4-Fluorobenzoyl)quinolizidine, 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-, (4-fluorophenyl)[(2s,9ar)-octahydro-2h-quinolizin-2-yl]methanone, 2H-Quinolizine, (2-axial-(4-fluorobenzoyl))octahydro-
| Molecular Formula | C16H20FNO |
|---|---|
| Molecular Weight | 261.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.1529 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 57661-47-9 |
|---|---|
| SMILES | C1CCN2CC[C@@H](C[C@H]2C1)C(=O)C3=CC=C(C=C3)F |
| InChIKey | SNUWKAZFIKLPCA-DZGCQCFKSA-N |
Product Overview
2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- (CAS 57661-47-9), with molecular formula C16H20FNO and molecular weight 261.15 g/mol. IUPAC: [(2S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-
Property Insights of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-
The XLogP value of 3.1 indicates that 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- 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 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-?
The CAS number of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- is 57661-47-9.
What is the molecular formula of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-?
The molecular formula of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- is C16H20FNO.
What is the molecular weight of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-?
The molecular weight of 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- is 261.15 g/mol.
Where can I buy 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-?
You can request a quote for 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Quinolizine, octahydro-2-axial-(4-fluorobenzoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.