SMILES:
CCn1cc(C(=O)c2ccc3c(c2C)CCCS3(=O)=O)c(OS(=O)(=O)c2ccc(C)cc2)n1Molecular Processing
Molecular formula
C23H24N2O6S2
Molecular weight
488.59
Exact mass
488.1076
XLogP
3.24
TPSA
112.4
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
121.88
Supplementary Information
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