SMILES:
Cc1cc(-c2cccc(C3=Nc4cc(Cl)c(Cl)cc4NC(=O)C3)c2)cc(C)n1Molecular Processing
Molecular formula
C22H17Cl2N3O
Molecular weight
410.3
Exact mass
409.0749
XLogP
6.14
TPSA
54.35
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
115.05
Supplementary Information
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