SMILES:
CCC(=O)NC1CCc2nc(NS(=O)(=O)c3c(C)cc(Cl)cc3Cl)sc2C1Molecular Processing
Molecular formula
C17H19Cl2N3O3S2
Molecular weight
448.4
Exact mass
447.0245
XLogP
3.94
TPSA
88.16
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
108.37
Supplementary Information
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