SMILES:
CS(=O)(=O)c1cc(F)c2c(c1)OC(CN1CCOCC1)CO2Molecular Processing
Molecular formula
C14H18FNO5S
Molecular weight
331.37
Exact mass
331.089
XLogP
0.7
TPSA
65.07
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
76.68
Supplementary Information
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