3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-
TL;DR: 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- (CAS 57269-25-7) is a chemical compound with molecular formula C15H19FN2O and molecular weight 262.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-1-(7-methyl-2,7-diazabicyclo[3.2.1]octan-2-yl)-2-phenylethanone
Also Known As: 5-23-03-00462 (Beilstein Handbook Reference), 3-(alpha-Fluoro-alpha-phenyl)acetyl-8-methyl-3,8-diazabicyclo(3.2.1)octane, 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-, 2-fluoro-1-(7-methyl-2,7-diazabicyclo[3.2.1]oct-2-yl)-2-phenylethanone, 3-(fluoro-phenyl-acetyl)-8-methyl-3,8-diaza-bicyclo[3.2.1]octane
| Molecular Formula | C15H19FN2O |
|---|---|
| Molecular Weight | 262.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.14813 |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 57269-25-7 |
|---|---|
| SMILES | CN1CC2CCN(C1C2)C(=O)C(C3=CC=CC=C3)F |
| InChIKey | RRFYFJJGMAQPAG-UHFFFAOYSA-N |
Product Overview
3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- (CAS 57269-25-7), with molecular formula C15H19FN2O and molecular weight 262.15 g/mol. IUPAC: 2-fluoro-1-(7-methyl-2,7-diazabicyclo[3.2.1]octan-2-yl)-2-phenylethanone.
Chemical Property Profile of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-
Property Insights of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-. With a topological polar surface area (TPSA) of 23.6 Ų, 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- 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 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-?
The CAS number of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- is 57269-25-7.
What is the molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-?
The molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- is C15H19FN2O.
What is the molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-?
The molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- is 262.15 g/mol.
Where can I buy 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-?
You can request a quote for 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3,8-Diazabicyclo(3.2.1)octane, 3-(alpha-fluoro-alpha-phenyl)acetyl-8-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.