N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide
TL;DR: N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide (CAS 1009781-54-7) is a chemical compound with molecular formula C25H31ClN2O4 and molecular weight 458.19724 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-chlorophenyl)-2-[1-(2,5-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]acetamide
Also Known As: N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide, N-(4-chlorophenyl)-2-[1-(2,5-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]acetamide, N-(4-chlorophenyl)-2-[1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetamide
Technical Specifications
| Molecular Formula | C25H31ClN2O4 |
| Molecular Weight | 458.19724 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 71.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.19724 Da |
| Heavy Atoms | 32 |
| Complexity | 629.0 |
| SMILES | COC1=CC(=C(C=C1)OC)C2C3CCCCC3(CCN2CC(=O)NC4=CC=C(C=C4)Cl)O |
| InChIKey | OMZCJLFMQVLRGE-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide
Property Insights of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide
The XLogP value of 4.2 indicates that N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide?
The CAS number of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide is 1009781-54-7.
What is the molecular formula of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide?
The molecular formula of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide is C25H31ClN2O4.
What is the molecular weight of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide?
The molecular weight of N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide is 458.19724 g/mol.
Where can I buy N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide?
You can request a quote for N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(4-chlorophenyl)-2-(1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.