COc1ccc(S(=O)(=O)NC(C)c2ccccc2-c2cc(F)ccc2F)cc1
SMILES: COc1ccc(S(=O)(=O)NC(C)c2ccccc2-c2cc(F)ccc2F)cc1

Molecular Processing

Molecular formula
C21H19F2NO3S
Molecular weight
403.45
Exact mass
403.1054
XLogP
4.68
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
103.52

Supplementary Information

Details werden geladen…

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