CC(=O)n1cc(O)c2c(=O)n(C)c3nc(-c4ccc(Cl)cc4Cl)c(-c4ccc(Cl)cc4)cc3c21
SMILES: CC(=O)n1cc(O)c2c(=O)n(C)c3nc(-c4ccc(Cl)cc4Cl)c(-c4ccc(Cl)cc4)cc3c21

Molecular Processing

Molecular formula
C25H16Cl3N3O3
Molecular weight
512.78
Exact mass
511.0257
XLogP
6.55
TPSA
77.12
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
34
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.08
Molar refractivity
136.35

Supplementary Information

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