SMILES:
CC(=O)OCc1nc2cc(Cl)c(CBr)cc2c(=O)[nH]1Molecular Processing
Molecular formula
C12H10BrClN2O3
Molecular weight
345.58
Exact mass
343.9563
XLogP
2.53
TPSA
72.05
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
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
0.25
Molar refractivity
75.47
Supplementary Information
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