1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
TL;DR: 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 858745-84-3) is a chemical compound with molecular formula C19H25N3O5 and molecular weight 375.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4-dione
Also Known As: 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione, 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-4,6-dihydroxypyrimidin-2(1H)-one, 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-pyrimidine-2,4-dione, 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4-dione
| Molecular Formula | C19H25N3O5 |
|---|---|
| Molecular Weight | 375.18 g/mol |
| LogP | 1.2946 |
| Topological Polar Surface Area | 105.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.1794 |
| Heavy Atoms | 27 |
| Complexity | 947.58203 |
Chemical Identifiers
| CAS Number | 858745-84-3 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)NC1=O)C2C3=CC(=C(C=C3CCN2)OC)OC)O |
Product Overview
1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 858745-84-3), with molecular formula C19H25N3O5 and molecular weight 375.18 g/mol. IUPAC: 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Property Insights of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.2946 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione. The TPSA of 105.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione has 3 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 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The CAS number of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione is 858745-84-3.
What is the molecular formula of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular formula of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione is C19H25N3O5.
What is the molecular weight of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular weight of 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione is 375.18 g/mol.
Where can I buy 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione?
You can request a quote for 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-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 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.