SMILES:
COc1ccc(S(=O)(=O)C(CC=C(C)C)(Cc2cccnc2)C(=O)NO)cc1Molecular Processing
Molecular formula
C20H24N2O5S
Molecular weight
404.49
Exact mass
404.1406
XLogP
2.71
TPSA
105.59
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
104.83
Supplementary Information
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