Name: (E)-3,4-difluoro-2-(2-fluoro-4-iodo-phenylamino)-N-(2-hydroxy-ethoxy)-5-(isopropoxyimino-methyl)-benzamide
SMILES:
CC(C)O/N=C/c1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)c(F)c1FMolecular Processing
Molecular formula
C19H19F3IN3O4
Molecular weight
537.28
Exact mass
537.0372
XLogP
3.86
TPSA
92.18
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
113.08
Supplementary Information
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