SMILES:
CS(=O)(=O)Nc1ccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc2c1.ClMolecular Processing
Molecular formula
C17H22ClN3O3S2
Molecular weight
415.97
Exact mass
415.0791
XLogP
2.52
TPSA
78.51
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.471
Molar refractivity
107.96
Supplementary Information
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