Name: N-[3-(4-Bromo-1-ethyl-1H-pyrazol-3-yl)-2,4-difluoro-phenyl]-2,5-difluoro-N-(2-methoxy-ethoxymethyl)-benzenesulfonamide
SMILES:
CCn1cc(Br)c(-c2c(F)ccc(N(COCCOC)S(=O)(=O)c3cc(F)ccc3F)c2F)n1Molecular Processing
Molecular formula
C21H20BrF4N3O4S
Molecular weight
566.37
Exact mass
565.0294
XLogP
4.7
TPSA
73.66
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
34
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
119.67
Supplementary Information
Details werden geladen…
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