methanone structure](/static/products/100/1008060-17-0.png)
[1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone
TL;DR: [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone (CAS 1008060-17-0) is a chemical compound with molecular formula C24H28FNO3 and molecular weight 397.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2-ethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3-fluorophenyl)methanone
Also Known As: [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone|(1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)(3-fluorophenyl)methanone|[1-(2-ethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3-fluorophenyl)methanone
| Molecular Formula | C24H28FNO3 |
|---|---|
| Molecular Weight | 397.21 g/mol |
| LogP | 4.7329 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.20532 |
| Heavy Atoms | 29 |
| Complexity | 885.93445 |
Chemical Identifiers
| CAS Number | 1008060-17-0 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C2C3CCCCC3(CCN2C(=O)C4=CC(=CC=C4)F)O |
Product Overview
[1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone (CAS 1008060-17-0), with molecular formula C24H28FNO3 and molecular weight 397.21 g/mol. IUPAC: [1-(2-ethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3-fluorophenyl)methanone.
Chemical Property Profile of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone
Property Insights of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone
The XLogP value of 4.7329 indicates that [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone 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
Frequently Asked Questions
What is the CAS number of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone?
The CAS number of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone is 1008060-17-0.
What is the molecular formula of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone?
The molecular formula of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone is C24H28FNO3.
What is the molecular weight of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone?
The molecular weight of [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone is 397.21 g/mol.
Where can I buy [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone?
You can request a quote for [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.