SMILES:
CCCS(=O)(=O)Oc1c(C(=O)c2ccc3c(c2C)CCCS3(=O)=O)cnn1CCMolecular Processing
Molecular formula
C19H24N2O6S2
Molecular weight
440.54
Exact mass
440.1076
XLogP
2.28
TPSA
112.4
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
107.59
Supplementary Information
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