![(1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium structure](/static/products/105/105369-42-4.webp)
(1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium
TL;DR: (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium (CAS 105369-42-4) is a chemical compound with molecular formula C17H24NO3+ and molecular weight 290.17563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-2-hydroxy-2-phenylacetate
Also Known As: (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium, [(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-2-hydroxy-2-phenylacetate, 8-Azoniabicyclo[3.2.1]octane, 3-[[(2R)-hydroxyphenylacetyl]oxy]-8,8-dimethyl-, (3-endo)-, (1beta,5beta)-3alpha-[[(R)-Hydroxy(phenyl)acetyl]oxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane, (1beta,5beta)-3alpha-[[(R)-Hydroxyphenylacetyl]oxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane
Technical Specifications
| Molecular Formula | C17H24NO3+ |
| Molecular Weight | 290.17563 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.17563 Da |
| Heavy Atoms | 21 |
| Complexity | 373.0 |
| SMILES | C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)[C@@H](C3=CC=CC=C3)O)C |
| InChIKey | WKWOJBUWWZTUQV-VFSICIBPSA-N |
Chemical Property Profile of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium
Property Insights of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium. With a topological polar surface area (TPSA) of 46.5 Ų, (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium?
The CAS number of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium is 105369-42-4.
What is the molecular formula of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium?
The molecular formula of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium is C17H24NO3+.
What is the molecular weight of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium?
The molecular weight of (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium is 290.17563 g/mol.
Where can I buy (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium?
You can request a quote for (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium?
Yes, CoreyChem provides custom synthesis services for (1R,3R,5S)-3-{[(2R)-2-hydroxy-2-phenylacetyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.