COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1-c1cc(-c2nc(C)no2)ccc1OC
SMILES: COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1-c1cc(-c2nc(C)no2)ccc1OC

Molecular Processing

Molecular formula
C29H22F9N3O4
Molecular weight
647.49
Exact mass
647.1467
XLogP
8.55
TPSA
77.69
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
45
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.276
Molar refractivity
139.56

Supplementary Information

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