CC(C)(C)c1ccc(CN(CCc2cc(F)cc(C(F)(F)F)c2)C(=O)c2cc(Cl)cc(Br)c2)cc1
SMILES: CC(C)(C)c1ccc(CN(CCc2cc(F)cc(C(F)(F)F)c2)C(=O)c2cc(Cl)cc(Br)c2)cc1

Molecular Processing

Molecular formula
C27H25BrClF4NO
Molecular weight
570.85
Exact mass
569.0744
XLogP
8.44
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
134.14

Supplementary Information

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