SMILES:
Cc1ccc(S(=O)(=O)C(NC=O)c2ccc(I)cc2)cc1Molecular Processing
Molecular formula
C15H14INO3S
Molecular weight
415.25
Exact mass
414.9739
XLogP
2.82
TPSA
63.24
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
89.46
Supplementary Information
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