N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide
TL;DR: N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide (CAS 1008016-45-2) is a chemical compound with molecular formula C24H36N2O3 and molecular weight 400.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4a-hydroxy-1-(4-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-cyclohexylacetamide
Also Known As: N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide, N-cyclohexyl-2-[4a-hydroxy-1-(4-methoxyphenyl)octahydro-2(1H)-isoquinolinyl]acetamide, N-cyclohexyl-2-[4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]acetamide, 2-[4a-hydroxy-1-(4-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-cyclohexylacetamide
| Molecular Formula | C24H36N2O3 |
|---|---|
| Molecular Weight | 400.27 g/mol |
| LogP | 3.8122 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.27258 |
| Heavy Atoms | 29 |
| Complexity | 685.8711 |
Chemical Identifiers
| CAS Number | 1008016-45-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3CCCCC3(CCN2CC(=O)NC4CCCCC4)O |
Product Overview
N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide (CAS 1008016-45-2), with molecular formula C24H36N2O3 and molecular weight 400.27 g/mol. IUPAC: 2-[4a-hydroxy-1-(4-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-cyclohexylacetamide.
Chemical Property Profile of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide
Property Insights of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide
The XLogP value of 3.8122 indicates that N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide. Following Lipinski's Rule of Five, N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide has 2 hydrogen bond donor(s) and 4 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 N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide?
The CAS number of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide is 1008016-45-2.
What is the molecular formula of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide?
The molecular formula of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide is C24H36N2O3.
What is the molecular weight of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide?
The molecular weight of N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide is 400.27 g/mol.
Where can I buy N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide?
You can request a quote for N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-2-(4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.