SMILES:
CC1(c2cc(Br)ccc2F)COC(Cc2ccccc2)C(=O)N1Molecular Processing
Molecular formula
C18H17BrFNO2
Molecular weight
378.24
Exact mass
377.0427
XLogP
3.56
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
89.48
Supplementary Information
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