5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
TL;DR: 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one (CAS 66968-44-3) is a chemical compound with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-ethylhexyl)-5-methyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-5-methylbarbituricacid, 5- -5-methylbarbituricacid, 5-(2-Ethylhexyl)-5-methylbarbituric acid, BARBITURIC ACID, 5-(2-ETHYLHEXYL)-5-METHYL-, 4-24-00-01968 (Beilstein Handbook Reference)
| Molecular Formula | C13H22N2O3 |
|---|---|
| Molecular Weight | 254.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.16304 |
| Heavy Atoms | 18 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 66968-44-3 |
|---|---|
| SMILES | CCCCC(CC)CC1(C(=O)NC(=O)NC1=O)C |
| InChIKey | JGUVWCOXXGNIJL-UHFFFAOYSA-N |
Product Overview
5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one (CAS 66968-44-3), with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol. IUPAC: 5-(2-ethylhexyl)-5-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
Property Insights of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
The XLogP value of 3.0 indicates that 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one. Following Lipinski's Rule of Five, 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-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-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The CAS number of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is 66968-44-3.
What is the molecular formula of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The molecular formula of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is C13H22N2O3.
What is the molecular weight of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The molecular weight of 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is 254.16 g/mol.
Where can I buy 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
You can request a quote for 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Ethylhexyl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.