SMILES:
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCC3(CC2)OCCO3)cc1Molecular Processing
Molecular formula
C21H25N3O5S
Molecular weight
431.51
Exact mass
431.1515
XLogP
2.79
TPSA
96.97
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
114.08
Supplementary Information
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