N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide
TL;DR: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide (CAS 517869-88-4) is a chemical compound with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide
Also Known As: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide, N-(6-acetyl(2H-benzo[d]1,3-dioxolan-5-yl))-2-(2-1,2,3,4-tetrahydroisoquinolyl) acetamide, N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide, N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydroisoquinolin-2(1H)-yl)acetamide, N-(6-ACETYL-1,3-BENZODIOXOL-5-YL)-2-[3,4-DIHYDRO-2(1H)-ISOQUINOLINYL]ACETAMIDE
| Molecular Formula | C20H20N2O4 |
|---|---|
| Molecular Weight | 352.14 g/mol |
| LogP | 2.6147 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.1423 |
| Heavy Atoms | 26 |
| Complexity | 878.11005 |
Chemical Identifiers
| CAS Number | 517869-88-4 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCC4=CC=CC=C4C3)OCO2 |
Product Overview
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide (CAS 517869-88-4), with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol. IUPAC: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide.
Chemical Property Profile of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide
Property Insights of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide
The XLogP value of 2.6147 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide. Following Lipinski's Rule of Five, N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide 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 N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide?
The CAS number of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide is 517869-88-4.
What is the molecular formula of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide?
The molecular formula of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide is C20H20N2O4.
What is the molecular weight of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide?
The molecular weight of N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide is 352.14 g/mol.
Where can I buy N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide?
You can request a quote for N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2(1H)-isoquinolinyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.