Nombre: ( 70 )
SMILES:
CC(C)Cc1cc(-c2ccc(-c3ccc(CCC#N)cc3CC(C)C)cc2Cc2cccc3ccccc23)ccc1OCC#NMolecular Processing
Molecular formula
C42H42N2O
Molecular weight
590.81
Exact mass
590.3297
XLogP
10.52
TPSA
56.81
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
12
Heavy atoms
45
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
0.286
Molar refractivity
186.19
Supplementary Information
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