SMILES:
NC1=NC(CF)(c2cc(Br)ccc2F)COC1Molecular Processing
Molecular formula
C11H11BrF2N2O
Molecular weight
305.12
Exact mass
304.0023
XLogP
2.14
TPSA
47.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
64.19
Supplementary Information
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