Nombre: compound B
SMILES:
COC(=O)c1ccccc1C=Nc1cc(C)ccc1OMolecular Processing
Molecular formula
C16H15NO3
Molecular weight
269.3
Exact mass
269.1052
XLogP
3.24
TPSA
58.89
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
77.88
Supplementary Information
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