![3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione structure](/static/products/118/1189682-66-3.png)
3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione
TL;DR: 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione (CAS 1189682-66-3) is a chemical compound with molecular formula C23H22ClN3O6 and molecular weight 471.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4-dione
Also Known As: 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione, 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione, 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4-dione
| Molecular Formula | C23H22ClN3O6 |
|---|---|
| Molecular Weight | 471.12 g/mol |
| LogP | 2.2098 |
| Topological Polar Surface Area | 95.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.11972 |
| Heavy Atoms | 33 |
| Complexity | 1379.1599 |
Chemical Identifiers
| CAS Number | 1189682-66-3 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C(=C2C1C4=C(N(C(=O)N(C4=O)C5=CC=C(C=C5)Cl)C)O)OC)OCO3 |
Product Overview
3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione (CAS 1189682-66-3), with molecular formula C23H22ClN3O6 and molecular weight 471.12 g/mol. IUPAC: 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4-dione.
Chemical Property Profile of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione
Property Insights of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.2098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione. The TPSA of 95.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione has 1 hydrogen bond donor(s) and 7 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 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione?
The CAS number of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione is 1189682-66-3.
What is the molecular formula of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione is C23H22ClN3O6.
What is the molecular weight of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione is 471.12 g/mol.
Where can I buy 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione?
You can request a quote for 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-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 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chlorophenyl)-6-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-methylpyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.