Name: 4-(2-fluoro-4-iodophenylamino)-1-(toluene-4-sulfonyl)-1H-indazole-5-carboxylic acid (2-vinyloxy-ethoxy)-amide
SMILES:
C=COCCONC(=O)c1ccc2c(cnn2S(=O)(=O)c2ccc(C)cc2)c1Nc1ccc(I)cc1FMolecular Processing
Molecular formula
C25H22FIN4O5S
Molecular weight
636.44
Exact mass
636.034
XLogP
4.89
TPSA
111.55
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.12
Molar refractivity
145.46
Supplementary Information
Details werden geladen…
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