SMILES:
Cn1c(=O)cnn(-c2cc(OS(C)(=O)=O)c(Cl)cc2Cl)c1=OMolecular Processing
Molecular formula
C11H9Cl2N3O5S
Molecular weight
366.18
Exact mass
364.964
XLogP
0.58
TPSA
100.26
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
80.57
Supplementary Information
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