Ethyl 4-Methyl-2-(methylthio)-6-oxo-1,6-dihydropyrimidine-5-carboxylate - CAS 344361-90-6
Catalog: |
BB022138 |
Product Name: |
Ethyl 4-Methyl-2-(methylthio)-6-oxo-1,6-dihydropyrimidine-5-carboxylate |
CAS: |
344361-90-6 |
Synonyms: |
4-methyl-2-(methylthio)-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester; ethyl 4-methyl-2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carboxylate |
IUPAC Name: | ethyl 4-methyl-2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carboxylate |
Description: | Ethyl 4-Methyl-2-(methylthio)-6-oxo-1,6-dihydropyrimidine-5-carboxylate (CAS# 344361-90-6 ) is a useful research chemical. |
Molecular Weight: | 228.27 |
Molecular Formula: | C9H12N2O3S |
Canonical SMILES: | CCOC(=O)C1=C(N=C(NC1=O)SC)C |
InChI: | InChI=1S/C9H12N2O3S/c1-4-14-8(13)6-5(2)10-9(15-3)11-7(6)12/h4H2,1-3H3,(H,10,11,12) |
InChI Key: | VNKIDUDNEBXUHO-UHFFFAOYSA-N |
LogP: | 1.38920 |
Publication Number | Title | Priority Date |
EP-2900639-B1 | Bicyclic dihydropyridone kinase inhibitors | 20120927 |
US-2015266871-A1 | Bicyclic dihydropyridone kinase inhibitors | 20120927 |
US-9533986-B2 | Bicyclic dihydropyridone kinase inhibitors | 20120927 |
WO-2014051653-A1 | Bicyclic dihydropyridone kinase inhibitors | 20120927 |
WO-2012065019-A2 | Pyridopyrimidinone inhibitors of p13k alpha | 20101112 |
Complexity: | 360 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.05686342 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.05686342 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 93.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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