methanone structure](/static/products/1005/1005136-50-4.webp)
[1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone
TL;DR: [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone (CAS 1005136-50-4) is a chemical compound with molecular formula C30H41NO7 and molecular weight 527.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2,4-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3,4,5-triethoxyphenyl)methanone
Also Known As: [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone|[1-(2,4-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3,4,5-triethoxyphenyl)methanone|2-(2,4-dimethoxyphenyl)-6-hydroxy-3-azabicyclo[4.4.0]dec-3-yl 3,4,5-triethoxyp henyl ketone
| Molecular Formula | C30H41NO7 |
|---|---|
| Molecular Weight | 527.29 g/mol |
| LogP | 5.4084 |
| Topological Polar Surface Area | 86.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 527.2883 |
| Heavy Atoms | 38 |
| Complexity | 1092.7705 |
Chemical Identifiers
| CAS Number | 1005136-50-4 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCC3(CCCCC3C2C4=C(C=C(C=C4)OC)OC)O |
Product Overview
[1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone (CAS 1005136-50-4), with molecular formula C30H41NO7 and molecular weight 527.29 g/mol. IUPAC: [1-(2,4-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-(3,4,5-triethoxyphenyl)methanone.
Chemical Property Profile of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone
Property Insights of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone
The XLogP value of 5.4084 indicates that [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.69 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone. Following Lipinski's Rule of Five, [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone?
The CAS number of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone is 1005136-50-4.
What is the molecular formula of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone?
The molecular formula of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone is C30H41NO7.
What is the molecular weight of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone?
The molecular weight of [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone is 527.29 g/mol.
Where can I buy [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone?
You can request a quote for [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.