![[(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone structure](/static/products/121/1212175-57-9.webp)
[(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone
TL;DR: [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone (CAS 1212175-57-9) is a chemical compound with molecular formula C17H23NO2 and molecular weight 273.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone
Also Known As: [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone|CHEMBL3438400
Technical Specifications
| Molecular Formula | C17H23NO2 |
| Molecular Weight | 273.17288 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.17288 Da |
| Heavy Atoms | 20 |
| Complexity | 362.0 |
| SMILES | CC1=CC=C(C=C1)C(=O)N2CC[C@]3(CCCC[C@H]3C2)O |
| InChIKey | YZXNMZOKTZMCBP-RDJZCZTQSA-N |
Chemical Property Profile of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone
Property Insights of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone. With a topological polar surface area (TPSA) of 40.5 Ų, [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone has 1 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 [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone?
The CAS number of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone is 1212175-57-9.
What is the molecular formula of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone?
The molecular formula of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone is C17H23NO2.
What is the molecular weight of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone?
The molecular weight of [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone is 273.17288 g/mol.
Where can I buy [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone?
You can request a quote for [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone?
Yes, CoreyChem provides custom synthesis services for [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(4-methylphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.