4,6-Dimethoxy-2-(methylsulfonyl)pyrimidine

C₇H₁₀N₂O₄SCAS 113583-35-0218.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₀N₂O₄S
Molar mass: 218.23 g/mol
Exact mass: 218.0361 Da
logP: -0.10Crippen estimate
Polar surface area: 78.4 Å²
H-bond donors / acceptors: 0 / 6
Rotatable bonds: 3

Identifiers

CAS number

113583-35-0

SMILES

COc1cc(OC)nc(S(C)(=O)=O)n1

InChIKey

ITDVJJVNAASTRS-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N2O4S/c1-12-5-4-6(13-2)9-7(8-5)14(3,10)11/h4H,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Pyrimidine, 4,6-dimethoxy-2-(methylsulfonyl)-
2-Methanesulfonyl-4,6-dimethoxypyrimidine
2-(Methylsulfonyl)-4,6-dimethoxypyrimidine

Work with 4,6-Dimethoxy-2-(methylsulfonyl)pyrimidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,6-Dimethyl-2-(methylsulfonyl)pyrimidine35144-22-052 % similar 2,4,6-Trimethoxypyrimidine13106-85-948 % similar 2-Chloro-4,6-dimethoxypyrimidine13223-25-147 % similar 2-(Chloromethyl)-4,6-dimethoxypyrimidine114108-86-041 % similar 5-Bromo-2-(methylsulfonyl)pyrimidine38275-48-837 % similar 4-Chloro-2-(methylsulfonyl)pyrimidine97229-11-337 % similar 2,6-Dimethoxy-4-pyrimidinamine3289-50-736 % similar 4-Chloro-2,6-dimethoxypyrimidine6320-15-636 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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