O=[N+]([O-])c1ccc2nc(OS(=O)(=S)c3ccccc3)sc2c1
SMILES: O=[N+]([O-])c1ccc2nc(OS(=O)(=S)c3ccccc3)sc2c1

Molecular Processing

Molecular formula
C13H8N2O4S3
Molecular weight
352.42
Exact mass
351.9646
XLogP
3.3
TPSA
82.33
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
87.12

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt