2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide
TL;DR: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide (CAS 879465-72-2) is a chemical compound with molecular formula C19H21N3O5 and molecular weight 371.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide
Also Known As: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide, 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-(3-nitrophenyl)acetamide
| Molecular Formula | C19H21N3O5 |
|---|---|
| Molecular Weight | 371.15 g/mol |
| LogP | 2.6088 |
| Topological Polar Surface Area | 93.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.14813 |
| Heavy Atoms | 27 |
| Complexity | 868.41876 |
Chemical Identifiers
| CAS Number | 879465-72-2 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC |
Product Overview
2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide (CAS 879465-72-2), with molecular formula C19H21N3O5 and molecular weight 371.15 g/mol. IUPAC: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide
Property Insights of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide
The XLogP value of 2.6088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide. The TPSA of 93.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide has 1 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-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide?
The CAS number of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide is 879465-72-2.
What is the molecular formula of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide?
The molecular formula of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide is C19H21N3O5.
What is the molecular weight of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide?
The molecular weight of 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide is 371.15 g/mol.
Where can I buy 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide?
You can request a quote for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-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-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.