COC(=O)C1=C(O)c2sc3ccccc3c2S(=O)(=O)N1C
SMILES: COC(=O)C1=C(O)c2sc3ccccc3c2S(=O)(=O)N1C

Molecular Processing

Molecular formula
C13H11NO5S2
Molecular weight
325.37
Exact mass
325.0079
XLogP
1.94
TPSA
83.91
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
78.34

Supplementary Information

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