3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione
TL;DR: 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 858740-80-4) is a chemical compound with molecular formula C20H19N3O3 and molecular weight 349.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4-dione
Also Known As: 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione, 1-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4-dione
| Molecular Formula | C20H19N3O3 |
|---|---|
| Molecular Weight | 349.14 g/mol |
| LogP | 1.5256 |
| Topological Polar Surface Area | 87.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.14264 |
| Heavy Atoms | 26 |
| Complexity | 1053.8868 |
Chemical Identifiers
| CAS Number | 858740-80-4 |
|---|---|
| SMILES | C1CNC(C2=CC=CC=C21)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)O |
Product Overview
3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 858740-80-4), with molecular formula C20H19N3O3 and molecular weight 349.14 g/mol. IUPAC: 1-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4-dione.
Chemical Property Profile of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Property Insights of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.5256 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione. The TPSA of 87.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione has 3 hydrogen bond donor(s) and 4 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-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione?
The CAS number of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione is 858740-80-4.
What is the molecular formula of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione is C20H19N3O3.
What is the molecular weight of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione is 349.14 g/mol.
Where can I buy 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-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-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.