SMILES:
CC(C)(C)OC(=O)N1CCC(c2ccc(S(=O)(=O)c3cccc(F)c3)cc2CO)C1Molecular Processing
Molecular formula
C22H26FNO5S
Molecular weight
435.52
Exact mass
435.1516
XLogP
3.88
TPSA
83.91
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
109.38
Supplementary Information
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