SMILES:
Cc1cc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)ClMolecular Processing
Molecular formula
C18H11Cl3F3NO2
Molecular weight
436.64
Exact mass
434.9807
XLogP
6.26
TPSA
38.66
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
97.8
Supplementary Information
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