SMILES:
Cc1nccc(-c2cccc(C3=Nc4cc(Cl)c(C(F)(F)F)cc4NC(=O)C3)c2)c1CMolecular Processing
Molecular formula
C23H17ClF3N3O
Molecular weight
443.86
Exact mass
443.1012
XLogP
6.5
TPSA
54.35
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.174
Molar refractivity
115.04
Supplementary Information
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