SMILES:
Cc1cc(S(C)(=O)=O)c(S(C)(=O)=O)cc1C(=O)N=C(N)NMolecular Processing
Molecular formula
C11H15N3O5S2
Molecular weight
333.39
Exact mass
333.0453
XLogP
-0.78
TPSA
149.75
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
77.54
Supplementary Information
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