SMILES:
O=C(N1CCCC2c3cc(OS(=O)(=O)C(F)(F)F)ccc3CC21)C(F)(F)FMolecular Processing
Molecular formula
C15H13F6NO4S
Molecular weight
417.33
Exact mass
417.0469
XLogP
3.11
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
79.28
Supplementary Information
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