SMILES:
CSCc1cccc2c(C(C)(CCOS(C)(=O)=O)c3ccc(C(F)(F)F)cc3)c[nH]c12Molecular Processing
Molecular formula
C22H24F3NO3S2
Molecular weight
471.57
Exact mass
471.115
XLogP
5.72
TPSA
59.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
118.83
Supplementary Information
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