CC(C)Oc1c(C#N)cnc2ccc(C=C3NC(NCc4ccc(C(F)(F)F)cc4C(F)(F)F)=NC3=O)nc12
SMILES: CC(C)Oc1c(C#N)cnc2ccc(C=C3NC(NCc4ccc(C(F)(F)F)cc4C(F)(F)F)=NC3=O)nc12

Molecular Processing

Molecular formula
C25H18F6N6O2
Molecular weight
548.45
Exact mass
548.1395
XLogP
4.94
TPSA
112.29
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
126.86

Supplementary Information

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