Name: N-(5-Bromo-4-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-methoxyacetamide
SMILES:
COCC(=O)Nc1c[nH]c2ncc(Br)c(F)c12Molecular Processing
Molecular formula
C10H9BrFN3O2
Molecular weight
302.1
Exact mass
300.9862
XLogP
2.05
TPSA
67.01
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
64.26
Supplementary Information
Details werden geladen…
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