COc1c(N=CN(C)C)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2n(CC(C)C)c1=O
SMILES: COc1c(N=CN(C)C)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2n(CC(C)C)c1=O

Molecular Processing

Molecular formula
C28H27Cl3N4O2
Molecular weight
557.91
Exact mass
556.12
XLogP
7.58
TPSA
59.72
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
155.13

Supplementary Information

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