SMILES:
COc1c(-c2ccc3cc(OS(=O)(=O)C(F)(F)C(F)(F)F)ccc3c2)cc(-n2ccc(=O)[nH]c2=O)cc1C(C)(C)CMolecular Processing
Molecular formula
C27H23F5N2O6S
Molecular weight
598.55
Exact mass
598.1197
XLogP
5.52
TPSA
107.46
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
41
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.259
Molar refractivity
141.4
Supplementary Information
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