CC(=O)Nc1ccc2[nH]c(C(=O)NCc3ccc(Cl)c(Oc4cc(Cl)cc(C#N)c4)c3F)cc2c1
SMILES: CC(=O)Nc1ccc2[nH]c(C(=O)NCc3ccc(Cl)c(Oc4cc(Cl)cc(C#N)c4)c3F)cc2c1

Molecular Processing

Molecular formula
C25H17Cl2FN4O3
Molecular weight
511.34
Exact mass
510.0662
XLogP
6.17
TPSA
107.01
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.08
Molar refractivity
131.42

Supplementary Information

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