![2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide structure](/static/products/102/1024123-07-6.png)
2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide
TL;DR: 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide (CAS 1024123-07-6) is a chemical compound with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-(4-nitrophenyl)acetamide
Also Known As: 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide, 2-(4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)-N-(4-nitrophenyl)acetamide, 2-[4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-(4-nitrophenyl)acetamide
| Molecular Formula | C24H29N3O5 |
|---|---|
| Molecular Weight | 439.21 g/mol |
| LogP | 3.9102 |
| Topological Polar Surface Area | 104.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.21072 |
| Heavy Atoms | 32 |
| Complexity | 979.8549 |
Chemical Identifiers
| CAS Number | 1024123-07-6 |
|---|---|
| SMILES | COC1=CC=CC=C1C2C3CCCCC3(CCN2CC(=O)NC4=CC=C(C=C4)[N+](=O)[O-])O |
Product Overview
2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide (CAS 1024123-07-6), with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol. IUPAC: 2-[4a-hydroxy-1-(2-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-(4-nitrophenyl)acetamide.
Chemical Property Profile of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide
Property Insights of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide
The XLogP value of 3.9102 indicates that 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide has 2 hydrogen bond donor(s) and 6 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-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide?
The CAS number of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide is 1024123-07-6.
What is the molecular formula of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide?
The molecular formula of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide is C24H29N3O5.
What is the molecular weight of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide?
The molecular weight of 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide is 439.21 g/mol.
Where can I buy 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide?
You can request a quote for 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.