5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
TL;DR: 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione (CAS 858738-43-9) is a chemical compound with molecular formula C19H23N3O6 and molecular weight 389.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
| Molecular Formula | C19H23N3O6 |
|---|---|
| Molecular Weight | 389.16 g/mol |
| LogP | 0.3008 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.1587 |
| Heavy Atoms | 28 |
| Complexity | 1068.8044 |
Chemical Identifiers
| CAS Number | 858738-43-9 |
|---|---|
| SMILES | CC(=O)N1CCC2=CC(=C(C=C2C1C3=C(N(C(=O)N(C3=O)C)C)O)OC)OC |
Product Overview
5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione (CAS 858738-43-9), with molecular formula C19H23N3O6 and molecular weight 389.16 g/mol. IUPAC: 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Property Insights of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.3008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione 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 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The CAS number of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is 858738-43-9.
What is the molecular formula of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The molecular formula of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is C19H23N3O6.
What is the molecular weight of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The molecular weight of 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is 389.16 g/mol.
Where can I buy 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
You can request a quote for 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.