3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine
TL;DR: 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine (CAS 135330-43-7) is a chemical compound with molecular formula C28H29F3N2 and molecular weight 450.22827 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R)-2-benzhydryl-N-[[2-(trifluoromethyl)phenyl]methyl]-1-azabicyclo[2.2.2]octan-3-amine
Also Known As: 3-Tbbq, 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine, (2R,3R)-2-benzhydryl-N-[[2-(trifluoromethyl)phenyl]methyl]-1-azabicyclo[2.2.2]octan-3-amine, 2-(Diphenylmethyl)-N-{[2-(trifluoromethyl)phenyl]methyl}-1-azabicyclo[2.2.2]octan-3-amine, 2-benzhydryl-N-[[2-(trifluoromethyl)phenyl]methyl]-1-azabicyclo[2.2.2]octan-3-amine
Technical Specifications
| Molecular Formula | C28H29F3N2 |
| Molecular Weight | 450.22827 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.22827 Da |
| Heavy Atoms | 33 |
| Complexity | 585.0 |
| SMILES | C1CN2CCC1[C@H]([C@H]2C(C3=CC=CC=C3)C4=CC=CC=C4)NCC5=CC=CC=C5C(F)(F)F |
| InChIKey | SJOKZBTYGQAZNH-KAYWLYCHSA-N |
Chemical Property Profile of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine
Property Insights of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine
The XLogP value of 6.3 indicates that 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine?
The CAS number of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine is 135330-43-7.
What is the molecular formula of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine?
The molecular formula of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine is C28H29F3N2.
What is the molecular weight of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine?
The molecular weight of 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine is 450.22827 g/mol.
Where can I buy 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine?
You can request a quote for 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine?
Yes, CoreyChem provides custom synthesis services for 3-(2-Trifluoromethylbenzylamino)-2-benzhydrylquinuclidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.