SMILES:
CSC(=O)OC1=C(c2ccccc2I)S(=O)(=O)N(CC(F)F)c2ncsc21Molecular Processing
Molecular formula
C15H11F2IN2O4S3
Molecular weight
544.36
Exact mass
543.8894
XLogP
4.49
TPSA
76.57
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
110.35
Supplementary Information
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