CC(C)C(C1=NC(=CC(=N1)OC)OC)C(=O)NS(=O)(=O)C
Название: 2-(4,6-dimethoxypyrimidin-2-yl)-3-methyl-N-methylsulfonylbutanamide
SMILES: CC(C)C(C1=NC(=CC(=N1)OC)OC)C(=O)NS(=O)(=O)C

Molecular Processing

Molecular formula
C12H19N3O5S
Molecular weight
317.37
Exact mass
317.1045
XLogP
0.31
TPSA
107.48
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
75.7

Supplementary Information

InChIKey: FYQIFUORZNNINT-UHFFFAOYSA-N
Синонимы
SCHEMBL9131825FYQIFUORZNNINT-UHFFFAOYSA-N2-(4,6-dimethoxypyrimidin-2-yl)-3-methyl-N-methylsulfonylbutyric acid amide
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