SMILES:
CNC(=O)c1cc(Oc2ccc3nc(S(C)=O)sc3c2)ccn1Molecular Processing
Molecular formula
C15H13N3O3S2
Molecular weight
347.42
Exact mass
347.0398
XLogP
2.58
TPSA
81.18
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
89.65
Supplementary Information
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