SMILES:
COC(=O)c1ccc(OC)c(-c2cc(C(F)(F)F)cc3[nH]ncc23)c1Molecular Processing
Molecular formula
C17H13F3N2O3
Molecular weight
350.3
Exact mass
350.0878
XLogP
4.04
TPSA
64.21
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
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
0.176
Molar refractivity
84.42
Supplementary Information
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