Name: N-[6-bromo-2-(3-fluorophenyl)-4-quinolinyl]-N,N-dimethylamine
SMILES:
CN(C)c1cc(-c2cccc(F)c2)nc2ccc(Br)cc12Molecular Processing
Molecular formula
C17H14BrFN2
Molecular weight
345.21
Exact mass
344.0324
XLogP
4.87
TPSA
16.13
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
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
0.118
Molar refractivity
89.16
Supplementary Information
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