SMILES:
CC(C)N1CCC2c3ccc(S(=O)(=O)c4ccccc4)cc3OCC21.ClMolecular Processing
Molecular formula
C20H24ClNO3S
Molecular weight
393.94
Exact mass
393.1165
XLogP
3.9
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.4
Molar refractivity
104.07
Supplementary Information
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