SMILES:
O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C(NC1CCC1)N2Molecular Processing
Molecular formula
C11H12N4O4S
Molecular weight
296.31
Exact mass
296.0579
XLogP
1.21
TPSA
113.7
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
72.11
Supplementary Information
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