3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
TL;DR: 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (CAS 1189423-60-6) is a chemical compound with molecular formula C27H24BrN3O4S and molecular weight 565.0671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-3-phenyl-2-sulfanylidenepyrimidin-4-one
Also Known As: 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 1-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-3-phenyl-2-sulfanylidenepyrimidin-4-one
Technical Specifications
| Molecular Formula | C27H24BrN3O4S |
| Molecular Weight | 565.0671 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 565.0671 Da |
| Heavy Atoms | 36 |
| Complexity | 858.0 |
| SMILES | COC1=C(C=C2C(NCCC2=C1)C3=C(N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br)O)OC |
| InChIKey | KDVJHFAVAZNKBL-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Property Insights of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
The XLogP value of 4.7 indicates that 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The CAS number of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 1189423-60-6.
What is the molecular formula of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular formula of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is C27H24BrN3O4S.
What is the molecular weight of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular weight of 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 565.0671 g/mol.
Where can I buy 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
You can request a quote for 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
Yes, CoreyChem provides custom synthesis services for 3-(4-bromophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.