Nom: t-butyl 2-(2-(3-cyanophenyl)-4-((4-fluorophenylsulfonamido)methyl)phenoxy)acetate
SMILES:
CC(C)(C)OC(=O)COc1ccc(CNS(=O)(=O)c2ccc(F)cc2)cc1-c1cccc(C#N)c1Molecular Processing
Molecular formula
C26H25FN2O5S
Molecular weight
496.56
Exact mass
496.1468
XLogP
4.56
TPSA
105.49
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
128.36
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→