SMILES:
COC(=O)c1ccnc(-c2ccc(Cl)cc2F)c1Molecular Processing
Molecular formula
C13H9ClFNO2
Molecular weight
265.67
Exact mass
265.0306
XLogP
3.33
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
65.98
Supplementary Information
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