SMILES:
CS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1C1C=CCC1Molecular Processing
Molecular formula
C14H17N3O3S
Molecular weight
307.38
Exact mass
307.0991
XLogP
0.94
TPSA
115.61
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
80.81
Supplementary Information
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