SMILES:
CSCc1cccc2c(C(C)(CCOS(C)(=O)=O)c3ccc(Cl)cc3)c[nH]c12Molecular Processing
Molecular formula
C21H24ClNO3S2
Molecular weight
438.01
Exact mass
437.0886
XLogP
5.36
TPSA
59.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
118.84
Supplementary Information
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