SMILES:
O=[N+]([O-])N=C(NCc1cnc(Cl)s1)NCc1cnc(Cl)s1Molecular Processing
Molecular formula
C9H8Cl2N6O2S2
Molecular weight
367.24
Exact mass
365.9527
XLogP
2.33
TPSA
105.34
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
82.36
Supplementary Information
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