CC(=O)c1ccc(Cn2ncc(NC(=O)c3nc(C)oc3-c3cccc(OC(F)(F)F)c3)n2)o1
SMILES: CC(=O)c1ccc(Cn2ncc(NC(=O)c3nc(C)oc3-c3cccc(OC(F)(F)F)c3)n2)o1

Molecular Processing

Molecular formula
C21H16F3N5O5
Molecular weight
475.38
Exact mass
475.1104
XLogP
4.24
TPSA
125.28
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
109.15

Supplementary Information

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