SMILES:
CCOC(=O)CCCCc1ccc2cc(O)c(N3CC(=O)NS3(=O)=O)cc2c1Molecular Processing
Molecular formula
C19H22N2O6S
Molecular weight
406.46
Exact mass
406.1199
XLogP
2
TPSA
113.01
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
104.21
Supplementary Information
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