O=C(OC(c1ccccc1)C(F)(F)C(=O)[O-])C12CC3CC(CC(C3)C1)C2.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
SMILES: O=C(OC(c1ccccc1)C(F)(F)C(=O)[O-])C12CC3CC(CC(C3)C1)C2.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

Molecular Processing

Molecular formula
C38H36F2O4S
Molecular weight
626.77
Exact mass
626.2302
XLogP
7.65
TPSA
66.43
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
45
Rings
8
Aromatic rings
4
Saturated rings
4
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.316
Molar refractivity
167.32

Supplementary Information

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