Cc1ccc(S(=O)(=O)N2C(F)C(=O)Nc3ccc([N+](=O)[O-])cc3C2c2ccccc2)cc1
SMILES: Cc1ccc(S(=O)(=O)N2C(F)C(=O)Nc3ccc([N+](=O)[O-])cc3C2c2ccccc2)cc1

Molecular Processing

Molecular formula
C22H18FN3O5S
Molecular weight
455.47
Exact mass
455.0951
XLogP
3.93
TPSA
109.62
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
115.11

Supplementary Information

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