Nom: t-butyl 2-(2-bromo-4-((4-fluorophenylsulfonamido)methyl)phenoxy)acetate
SMILES:
CC(C)(C)OC(=O)COc1ccc(CNS(=O)(=O)c2ccc(F)cc2)cc1BrMolecular Processing
Molecular formula
C19H21BrFNO5S
Molecular weight
474.35
Exact mass
473.0308
XLogP
3.79
TPSA
81.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
105.91
Supplementary Information
Récupération des détails…
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