SMILES:
CC(=O)c1ccc(-c2c(-c3ccc(Cl)cc3)ccn3c(=O)n(Cc4ccc(C(F)(F)F)nc4)nc23)cc1Molecular Processing
Molecular formula
C27H18ClF3N4O2
Molecular weight
522.91
Exact mass
522.107
XLogP
6.15
TPSA
69.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
37
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
133.68
Supplementary Information
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