SMILES:
CS(=O)(=O)OCC1CN(c2ccc(I)c(F)c2)C(=O)O1Molecular Processing
Molecular formula
C11H11FINO5S
Molecular weight
415.18
Exact mass
414.9387
XLogP
1.73
TPSA
72.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
77.53
Supplementary Information
Details werden geladen…
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