SMILES:
Cn1c(=O)n(CCCO)c(=O)c2c(Cc3ccc(C(F)(F)F)cc3)c(Oc3cccc(C(F)(F)F)c3)cnc21Molecular Processing
Molecular formula
C26H21F6N3O4
Molecular weight
553.46
Exact mass
553.1436
XLogP
4.9
TPSA
86.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
39
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
0.269
Molar refractivity
128.71
Supplementary Information
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