SMILES:
N=C(N)N1Cc2ccccc2C2(Cc3ccccc3O2)C1.O=[N+]([O-])OMolecular Processing
Molecular formula
C17H18N4O4
Molecular weight
342.36
Exact mass
342.1328
XLogP
1.88
TPSA
125.71
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.235
Molar refractivity
90
Supplementary Information
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