Name: 6-[2-(3-Benzyl-3H-imidazol-4-yl)-ethoxy]-4-(3-chloro-phenyl)-1-methyl-8-propyl-1H-quinolin-2-one
SMILES:
CCCc1cc(OCCc2cncn2Cc2ccccc2)cc2c(-c3cccc(Cl)c3)cc(=O)n(C)c12Molecular Processing
Molecular formula
C31H30ClN3O2
Molecular weight
512.05
Exact mass
511.2027
XLogP
6.68
TPSA
49.05
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
37
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.226
Molar refractivity
150.6
Supplementary Information
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