Nombre: N-(3-acetyl-5-benzyloxy-2-hydroxy-phenyl)-2-bromo-2-methyl-propionamide
SMILES:
CC(=O)c1cc(OCc2ccccc2)cc(NC(=O)C(C)(C)Br)c1OMolecular Processing
Molecular formula
C19H20BrNO4
Molecular weight
406.28
Exact mass
405.0576
XLogP
4.29
TPSA
75.63
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
100.52
Supplementary Information
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