SMILES:
O=C=Nc1ccc(Oc2ncc(Br)cn2)c(Cl)c1Molecular Processing
Molecular formula
C11H5BrClN3O2
Molecular weight
326.54
Exact mass
324.9254
XLogP
3.65
TPSA
64.44
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
69.04
Supplementary Information
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