2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-
TL;DR: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- (CAS 100849-52-3) is a chemical compound with molecular formula C14H16N2O3S and molecular weight 292.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-1,3-diazinane-2,4,6-trione
Also Known As: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-, 5-Ethyl-1-((methylthio)methyl)-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione, 2,4,6-Pyrimidinetrione, 5-ethyl-1-(methylthiomethyl)-5-phenyl-, 5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-1,3-diazinane-2,4,6-trione, 5-Ethyl-1-[(methylsulfanyl)methyl]-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione #
| Molecular Formula | C14H16N2O3S |
|---|---|
| Molecular Weight | 292.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.08817 |
| Heavy Atoms | 20 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 100849-52-3 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)N(C1=O)CSC)C2=CC=CC=C2 |
| InChIKey | JOTXNUQCZJLZDO-UHFFFAOYSA-N |
Product Overview
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- (CAS 100849-52-3), with molecular formula C14H16N2O3S and molecular weight 292.09 g/mol. IUPAC: 5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-
Property Insights of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-. Following Lipinski's Rule of Five, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- has 1 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 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-?
The CAS number of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- is 100849-52-3.
What is the molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-?
The molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- is C14H16N2O3S.
What is the molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-?
The molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- is 292.09 g/mol.
Where can I buy 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl-?
You can request a quote for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-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, 5-ethyl-1-((methylthio)methyl)-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-((methylthio)methyl)-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.