(1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
TL;DR: (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol (CAS 956908-64-8) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4aS,8aS)-1-(2-methoxyphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol
Also Known As: (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol, (1R,4aS,8aS)-1-(2-methoxyphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 2.6509 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 444.13 |
Chemical Identifiers
| CAS Number | 956908-64-8 |
|---|---|
| SMILES | COC1=CC=CC=C1[C@H]2[C@@H]3CCCC[C@@]3(CCN2)O |
Product Overview
(1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol (CAS 956908-64-8), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: (1R,4aS,8aS)-1-(2-methoxyphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol.
Chemical Property Profile of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Property Insights of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
The XLogP value of 2.6509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol. With a topological polar surface area (TPSA) of 41.49 Ų, (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol has 2 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 (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol?
The CAS number of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol is 956908-64-8.
What is the molecular formula of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol?
The molecular formula of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol is C16H23NO2.
What is the molecular weight of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol?
The molecular weight of (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol is 261.17 g/mol.
Where can I buy (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol?
You can request a quote for (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol?
Yes, KEHONG BIO provides custom synthesis services for (1R,4aS,8aS)-1-(2-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.