5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one
TL;DR: 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one (CAS 879437-31-7) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione
Also Known As: 5-benzyl-6-hydroxy-1-(o-tolyl)pyrimidine-2,4(1H,3H)-dione, 5-benzyl-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione, 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one
| Molecular Formula | C18H16N2O3 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 2.13062 |
| Topological Polar Surface Area | 75.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.1161 |
| Heavy Atoms | 23 |
| Complexity | 955.99097 |
Chemical Identifiers
| CAS Number | 879437-31-7 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=C(C(=O)NC2=O)CC3=CC=CC=C3)O |
Product Overview
5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one (CAS 879437-31-7), with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol. IUPAC: 5-benzyl-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one
Property Insights of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one
The XLogP value of 2.13062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one. The TPSA of 75.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one. Following Lipinski's Rule of Five, 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one has 2 hydrogen bond donor(s) and 3 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-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one?
The CAS number of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one is 879437-31-7.
What is the molecular formula of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one?
The molecular formula of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one is C18H16N2O3.
What is the molecular weight of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one?
The molecular weight of 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one is 308.12 g/mol.
Where can I buy 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one?
You can request a quote for 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.