Nombre: 2-(2-methoxy-pyridin-4-yl)-vinyl-2H-isoquinolin-1-one
SMILES:
COc1cc(C=Cn2ccc3ccccc3c2=O)ccn1Molecular Processing
Molecular formula
C17H14N2O2
Molecular weight
278.31
Exact mass
278.1055
XLogP
3.03
TPSA
44.12
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
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
0.059
Molar refractivity
84.22
Supplementary Information
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