![(2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone structure](/static/products/100/1005036-27-0.png)
(2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone
TL;DR: (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone (CAS 1005036-27-0) is a chemical compound with molecular formula C25H31NO5 and molecular weight 425.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(2,4-dimethoxyphenyl)methanone
Also Known As: (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone, [4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(2,4-dimethoxyphenyl)methanone
| Molecular Formula | C25H31NO5 |
|---|---|
| Molecular Weight | 425.22 g/mol |
| LogP | 4.2209 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.2202 |
| Heavy Atoms | 31 |
| Complexity | 945.25964 |
Chemical Identifiers
| CAS Number | 1005036-27-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)N2CCC3(CCCCC3C2C4=CC=CC=C4OC)O)OC |
Product Overview
(2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone (CAS 1005036-27-0), with molecular formula C25H31NO5 and molecular weight 425.22 g/mol. IUPAC: [4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(2,4-dimethoxyphenyl)methanone.
Chemical Property Profile of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone
Property Insights of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone
The XLogP value of 4.2209 indicates that (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.23 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone. Following Lipinski's Rule of Five, (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone has 1 hydrogen bond donor(s) and 5 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 (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone?
The CAS number of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone is 1005036-27-0.
What is the molecular formula of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone?
The molecular formula of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone is C25H31NO5.
What is the molecular weight of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone?
The molecular weight of (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone is 425.22 g/mol.
Where can I buy (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone?
You can request a quote for (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (2,4-dimethoxyphenyl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.