Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester
TL;DR: Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester (CAS 75274-19-0) is a chemical compound with molecular formula C10H13N3O3S and molecular weight 255.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-methyl-6-methylsulfanylpyrimidin-4-yl)amino]-2-oxoacetate
Also Known As: 4-Carbethoxy-carbonilamino-2-methyl-6-methylthio-pyrimidine, Ethyl ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxoacetate, Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester, ethyl 2-[(2-methyl-6-methylsulfanylpyrimidin-4-yl)amino]-2-oxoacetate, Ethyl {[2-methyl-6-(methylsulfanyl)pyrimidin-4-yl]amino}(oxo)acetate
| Molecular Formula | C10H13N3O3S |
|---|---|
| Molecular Weight | 255.07 g/mol |
| LogP | 1.00852 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.06776 |
| Heavy Atoms | 17 |
| Complexity | 436.80435 |
Chemical Identifiers
| CAS Number | 75274-19-0 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=CC(=NC(=N1)C)SC |
Product Overview
Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester (CAS 75274-19-0), with molecular formula C10H13N3O3S and molecular weight 255.07 g/mol. IUPAC: ethyl 2-[(2-methyl-6-methylsulfanylpyrimidin-4-yl)amino]-2-oxoacetate.
Chemical Property Profile of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester
Property Insights of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester
The XLogP value of 1.00852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester has 1 hydrogen bond donor(s) and 6 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 Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester?
The CAS number of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester is 75274-19-0.
What is the molecular formula of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester?
The molecular formula of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester is C10H13N3O3S.
What is the molecular weight of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester?
The molecular weight of Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester is 255.07 g/mol.
Where can I buy Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester?
You can request a quote for Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, ((2-methyl-6-(methylthio)-4-pyrimidinyl)amino)oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.