Nombre: 5-bromo-7-chloro-2-[(4,4-difluorocyclohexyl)methyl]isoindolin-1-one
SMILES:
O=C1c2c(Cl)cc(Br)cc2CN1CC1CCC(F)(F)CC1Molecular Processing
Molecular formula
C15H15BrClF2NO
Molecular weight
378.64
Exact mass
376.9994
XLogP
4.88
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
80.8
Supplementary Information
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