Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester
TL;DR: Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester (CAS 75274-20-3) is a chemical compound with molecular formula C15H19N3O7S and molecular weight 385.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-[2-[6-[(2-ethoxy-2-oxoacetyl)amino]-2-methylpyrimidin-4-yl]sulfanylethyl] 1-O-ethyl oxalate
Also Known As: Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester, 4-Carbethoxy-carbonilamino-2-methyl-6-(beta-carbethoxy-carboniloxy-ethylthio)-pyrimidine, 2-{[6-(2-Ethoxy-2-oxoacetamido)-2-methylpyrimidin-4-yl]sulfanyl}ethyl ethyl ethanedioate, 2-O-[2-[6-[(2-ethoxy-2-oxoacetyl)amino]-2-methylpyrimidin-4-yl]sulfanylethyl] 1-O-ethyl oxalate, RefChem:340112
| Molecular Formula | C15H19N3O7S |
|---|---|
| Molecular Weight | 385.09 g/mol |
| LogP | 0.48502 |
| Topological Polar Surface Area | 133.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.09436 |
| Heavy Atoms | 26 |
| Complexity | 681.2039 |
Chemical Identifiers
| CAS Number | 75274-20-3 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=CC(=NC(=N1)C)SCCOC(=O)C(=O)OCC |
Product Overview
Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester (CAS 75274-20-3), with molecular formula C15H19N3O7S and molecular weight 385.09 g/mol. IUPAC: 2-O-[2-[6-[(2-ethoxy-2-oxoacetyl)amino]-2-methylpyrimidin-4-yl]sulfanylethyl] 1-O-ethyl oxalate.
Chemical Property Profile of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester
Property Insights of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester
The XLogP value of 0.48502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester. The TPSA of 133.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester. Following Lipinski's Rule of Five, Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester has 1 hydrogen bond donor(s) and 10 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 Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester?
The CAS number of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester is 75274-20-3.
What is the molecular formula of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester?
The molecular formula of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester is C15H19N3O7S.
What is the molecular weight of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester?
The molecular weight of Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester is 385.09 g/mol.
Where can I buy Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester?
You can request a quote for Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Ethanedioic acid, 2-((6-((ethoxyoxoacetyl)amino)-2-methyl-4-pyrimidinyl)thio)ethyl ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.