SMILES:
CCOC(=O)C1CCc2nc(NC(C)=O)sc2C1Molecular Processing
Molecular formula
C12H16N2O3S
Molecular weight
268.34
Exact mass
268.0882
XLogP
1.77
TPSA
68.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
68.57
Supplementary Information
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