SMILES:
Cc1ccccc1-c1cccc2c1cc(C#N)n2CCCOc1cccc2ccccc12Molecular Processing
Molecular formula
C29H24N2O
Molecular weight
416.52
Exact mass
416.1889
XLogP
7.11
TPSA
37.95
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
32
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.138
Molar refractivity
130.89
Supplementary Information
Obteniendo detalles…
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