SMILES:
Cc1c(Cl)cccc1S(=O)(=O)Nc1nc(CCN(CCO)C(=O)C(Cl)Cl)cs1Molecular Processing
Molecular formula
C16H18Cl3N3O4S2
Molecular weight
486.83
Exact mass
484.9804
XLogP
3.07
TPSA
99.6
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
111.98
Supplementary Information
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