1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium
TL;DR: 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium (CAS 63184-36-1) is a chemical compound with molecular formula C7H11N2O+ and molecular weight 139.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-methylpyrimidin-1-ium-4-one
Also Known As: 1-ethyl-3-methylpyrimidin-1-ium-4-one, 1-ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium, 1-ethyl-3-methylhydropyrimidin-4-one, 3-Ethyl-1-methyl-6-oxo-3,6-dihydropyrimidin-1-ium
| Molecular Formula | C7H11N2O+ |
|---|---|
| Molecular Weight | 139.09 g/mol |
| LogP | -0.3073 |
| Topological Polar Surface Area | 25.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.08714 |
| Heavy Atoms | 10 |
| Complexity | 277.17975 |
Chemical Identifiers
| CAS Number | 63184-36-1 |
|---|---|
| SMILES | CC[N+]1=CN(C(=O)C=C1)C |
Product Overview
1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium (CAS 63184-36-1), with molecular formula C7H11N2O+ and molecular weight 139.09 g/mol. IUPAC: 1-ethyl-3-methylpyrimidin-1-ium-4-one.
Chemical Property Profile of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium
Property Insights of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium
The XLogP value of -0.3073 indicates that 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 25.88 Ų, 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium has 0 hydrogen bond donor(s) and 1 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 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium?
The CAS number of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium is 63184-36-1.
What is the molecular formula of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium?
The molecular formula of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium is C7H11N2O+.
What is the molecular weight of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium?
The molecular weight of 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium is 139.09 g/mol.
Where can I buy 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium?
You can request a quote for 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-methyl-4-oxo-1,4-dihydropyrimidin-3-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.