Nom: compound
SMILES:
Cc1ccc(OC(=O)c2nc3ccccc3[nH]2)cc1Molecular Processing
Molecular formula
C15H12N2O2
Molecular weight
252.27
Exact mass
252.0899
XLogP
3.09
TPSA
54.98
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
72.23
Supplementary Information
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