CC(C)CN1C(=O)C(=CC(=N1)C2=C(C=C(C=C2)F)F)COS(=O)(=O)C
Name: [6-(2,4-difluorophenyl)-2-(2-methylpropyl)-3-oxopyridazin-4-yl]methyl methanesulfonate
SMILES: CC(C)CN1C(=O)C(=CC(=N1)C2=C(C=C(C=C2)F)F)COS(=O)(=O)C

Molecular Processing

Molecular formula
C16H18F2N2O4S
Molecular weight
372.39
Exact mass
372.0955
XLogP
2.32
TPSA
78.26
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
88.32

Supplementary Information

InChIKey: MAZNQFHCTUMNRA-UHFFFAOYSA-N
Synonyms
SCHEMBL1925618MAZNQFHCTUMNRA-UHFFFAOYSA-N6-(2,4-difluorophenyl)-2-isobutyl-4-methanesulfonyloxym ethyl-2H-pyridazin-3-one6-(2,4-difluorophenyl)-2-isobutyl-4-methanesulfonyloxymethy l-2H-pyridazin-3-one6-(2,4-difluorophenyl)-2-isobutyl-4-methanesulfonyloxymethyl-2H-pyridazin-3-one
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Involved in 33 reactions→

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