CCC(=O)c1oc(-c2ccc(C(F)(F)F)cc2)nc1C
SMILES: CCC(=O)c1oc(-c2ccc(C(F)(F)F)cc2)nc1C

Molecular Processing

Molecular formula
C14H12F3NO2
Molecular weight
283.25
Exact mass
283.082
XLogP
4.26
TPSA
43.1
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
66.3

Supplementary Information

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