2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-
TL;DR: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- (CAS 112769-18-3) is a chemical compound with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-pentyl-5-phenyl-1,3-diazinane-2,4,6-trione
Also Known As: MPPBA, 1-Methyl-5-pentyl-5-phenylbarbituric acid, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-, 1-methyl-5-pentyl-5-phenyl-1,3-diazinane-2,4,6-trione, 2,4,6(1H,3H,5H)-Pyrimidinetrione,1-methyl-5-pentyl-5-phenyl-, (S)- (9CI)
| Molecular Formula | C16H20N2O3 |
|---|---|
| Molecular Weight | 288.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.1474 |
| Heavy Atoms | 21 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 112769-18-3 |
|---|---|
| SMILES | CCCCCC1(C(=O)NC(=O)N(C1=O)C)C2=CC=CC=C2 |
| InChIKey | QPQAFLPWFVOKBJ-UHFFFAOYSA-N |
Product Overview
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- (CAS 112769-18-3), with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol. IUPAC: 1-methyl-5-pentyl-5-phenyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-
Property Insights of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-
The XLogP value of 3.5 indicates that 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-. Following Lipinski's Rule of Five, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- has 1 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 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-?
The CAS number of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- is 112769-18-3.
What is the molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-?
The molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- is C16H20N2O3.
What is the molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-?
The molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- is 288.15 g/mol.
Where can I buy 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-?
You can request a quote for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-pentyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.