O=[N+]([O-])c1ccc(-c2c[nH]nc2OCc2ccccc2)cc1
SMILES: O=[N+]([O-])c1ccc(-c2c[nH]nc2OCc2ccccc2)cc1

Molecular Processing

Molecular formula
C16H13N3O3
Molecular weight
295.3
Exact mass
295.0957
XLogP
3.56
TPSA
81.05
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
81.45

Supplementary Information

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