SMILES:
Cc1nc2ccc(C3CC3)cc2c(N2CCOCC2)c1S(C)(=O)=OMolecular Processing
Molecular formula
C18H22N2O3S
Molecular weight
346.45
Exact mass
346.1351
XLogP
2.66
TPSA
59.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
94.6
Supplementary Information
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