COC(=O)c1csc(-c2ccc(OC(C)=O)c(OC(C)=O)c2)n1
SMILES: COC(=O)c1csc(-c2ccc(OC(C)=O)c(OC(C)=O)c2)n1

Molecular Processing

Molecular formula
C15H13NO6S
Molecular weight
335.34
Exact mass
335.0464
XLogP
2.45
TPSA
91.79
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
81.51

Supplementary Information

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