SMILES:
N#Cc1ccc2c(cc(C(F)F)n2Cc2noc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)c1ClMolecular Processing
Molecular formula
C21H9ClF8N4O
Molecular weight
520.77
Exact mass
520.0337
XLogP
7.24
TPSA
67.64
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
105.46
Supplementary Information
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