Name: 3,4-difluoro-2-(2-fluoro-4-iodo-phenylamino)-N-(2-hydroxy-ethoxy)-5-[(2-methanesulfinyl-ethoxyamino)-methyl]-benzamide
SMILES:
CS(=O)CCONCc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)c(F)c1FMolecular Processing
Molecular formula
C19H21F3IN3O5S
Molecular weight
587.36
Exact mass
587.0199
XLogP
2.51
TPSA
108.92
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
32
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
120.99
Supplementary Information
Details werden geladen…
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