SMILES:
Cc1c(C2=NN(Cc3cccc(F)c3)S(=O)(=O)c3ccccc32)c2cc(F)ccc2n1CC(=O)OMolecular Processing
Molecular formula
C25H19F2N3O4S
Molecular weight
495.51
Exact mass
495.1064
XLogP
4.27
TPSA
91.97
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.12
Molar refractivity
125.48
Supplementary Information
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