NS(=O)(=O)c1cccc(-c2cc(-c3nc(-c4cccc(C(F)(F)F)c4)cc(C(F)(F)F)n3)ccn2)c1
SMILES: NS(=O)(=O)c1cccc(-c2cc(-c3nc(-c4cccc(C(F)(F)F)c4)cc(C(F)(F)F)n3)ccn2)c1

Molecular Processing

Molecular formula
C23H14F6N4O2S
Molecular weight
524.45
Exact mass
524.0742
XLogP
5.56
TPSA
98.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.087
Molar refractivity
117.51

Supplementary Information

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