SMILES:
CCOC(=O)c1sc(NS(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)nc1CMolecular Processing
Molecular formula
C13H11Cl3N2O4S2
Molecular weight
429.73
Exact mass
427.9226
XLogP
4.39
TPSA
85.36
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
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
0.231
Molar refractivity
95.09
Supplementary Information
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