SMILES:
CC(O)(c1ccc(N2CCN(S(=O)(=O)c3cccs3)CC2COCc2ccccc2)cc1)C(F)(F)FMolecular Processing
Molecular formula
C25H27F3N2O4S2
Molecular weight
540.63
Exact mass
540.1364
XLogP
4.61
TPSA
70.08
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
132.38
Supplementary Information
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