SMILES:
CC(=O)c1ccc(OCc2cc(Cl)ccn2)c(Br)c1Molecular Processing
Molecular formula
C14H11BrClNO2
Molecular weight
340.6
Exact mass
338.9662
XLogP
4.28
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
77.73
Supplementary Information
Obteniendo detalles…
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