SMILES:
CS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)c(C#N)c2SCc2ccccc2F)nc1Molecular Processing
Molecular formula
C18H12F4N4O2S2
Molecular weight
456.45
Exact mass
456.0338
XLogP
3.99
TPSA
88.64
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
100.15
Supplementary Information
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