이름: 1-(6-chloro-3-fluoropyridin-2-yl)-2,2-difluoro-2-(quinolin-6-yl)ethanone oxime
SMILES:
ON=C(c1nc(Cl)ccc1F)C(F)(F)c1ccc2ncccc2c1Molecular Processing
Molecular formula
C16H9ClF3N3O
Molecular weight
351.72
Exact mass
351.0386
XLogP
4.39
TPSA
58.37
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
83.17
Supplementary Information
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