COc1ncc(F)cc1-c1cc(C=Cc2ccc(NS(=O)(=O)CC(F)(F)F)cn2)c(OC)c(C(C)(C)C)c1
SMILES: COc1ncc(F)cc1-c1cc(C=Cc2ccc(NS(=O)(=O)CC(F)(F)F)cn2)c(OC)c(C(C)(C)C)c1

Molecular Processing

Molecular formula
C26H27F4N3O4S
Molecular weight
553.58
Exact mass
553.1658
XLogP
6.07
TPSA
90.41
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
38
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
138.06

Supplementary Information

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