SMILES:
COC(=O)[C@H]1C[C@H](S(=O)(=O)c2ccccc2Cl)C[C@@H]1OC(C)(C)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C22H24Cl2O5S
Molecular weight
471.4
Exact mass
470.0722
XLogP
5.04
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
116.52
Supplementary Information
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