SMILES:
O=C(OCc1ccccc1)C1CCCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1Molecular Processing
Molecular formula
C20H20F3NO4S
Molecular weight
427.44
Exact mass
427.1065
XLogP
3.99
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
99.21
Supplementary Information
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