CNC(CN1CCOCC1)c1ccc(Br)c(F)c1
SMILES: CNC(CN1CCOCC1)c1ccc(Br)c(F)c1

Molecular Processing

Molecular formula
C13H18BrFN2O
Molecular weight
317.2
Exact mass
316.0587
XLogP
2.18
TPSA
24.5
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
73.16

Supplementary Information

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