SMILES:
O=C1[C@@H](N2CCC(c3cc(Cl)cc(Cl)c3)C2)CCN1c1cc(F)c(S(=O)(=O)Nc2nccs2)c(F)c1Molecular Processing
Molecular formula
C23H20Cl2F2N4O3S2
Molecular weight
573.47
Exact mass
572.0322
XLogP
5.12
TPSA
82.61
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
135.43
Supplementary Information
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