(R)-RS-42358
TL;DR: (R)-RS-42358 (CAS 135729-57-6) is a chemical compound with molecular formula C19H22N2O and molecular weight 294.17322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5,6-dihydro-4H-benzo[de]isoquinolin-1-one
Also Known As: (R)-RS-42358, 2-(3R)-1-Azabicyclo[2.2.2]oct-3-yl-2,4,5,6-tetrahydro-1H-benz[de]isoquinolin-1-one, 2-[(3R)-Quinuclidin-3-yl]-2,4,5,6-tetrahydro-1H-benz[de]isoquinolin-1-one, (3~{a}~{S})-2-[(3~{S})-1-azabicyclo[2.2.2]octan-3-yl]-3~{a},4,5,6-tetrahydro-3~{H}-benzo[de]isoquinolin-1-one, 2-[(3R)-1-Azabicyclo[2.2.2]octan-3-yl]-2,4,5,6-tetrahydro-1H-benzo[de]isoquinolin-1-one
Technical Specifications
| Molecular Formula | C19H22N2O |
| Molecular Weight | 294.17322 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.17322 Da |
| Heavy Atoms | 22 |
| Complexity | 506.0 |
| SMILES | C1CC2=C3C(=CN(C(=O)C3=CC=C2)[C@H]4CN5CCC4CC5)C1 |
| InChIKey | DIDFYSQVOPVZQB-KRWDZBQOSA-N |
Chemical Property Profile of (R)-RS-42358
Property Insights of (R)-RS-42358
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-RS-42358. With a topological polar surface area (TPSA) of 23.6 Ų, (R)-RS-42358 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-RS-42358 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (R)-RS-42358?
The CAS number of (R)-RS-42358 is 135729-57-6.
What is the molecular formula of (R)-RS-42358?
The molecular formula of (R)-RS-42358 is C19H22N2O.
What is the molecular weight of (R)-RS-42358?
The molecular weight of (R)-RS-42358 is 294.17322 g/mol.
Where can I buy (R)-RS-42358?
You can request a quote for (R)-RS-42358 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (R)-RS-42358?
Yes, CoreyChem provides custom synthesis services for (R)-RS-42358 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.