Название: (S)-methyl 3-(2-methylpyrrolidin-1-yl)-2-(trifluoromethylsulfonyloxy)quinoxaline-6-carboxylate
SMILES:
COC(=O)c1ccc2nc(OS(=O)(=O)C(F)(F)F)c(N3CCC[C@@H]3C)nc2c1Molecular Processing
Molecular formula
C16H16F3N3O5S
Molecular weight
419.38
Exact mass
419.0763
XLogP
2.63
TPSA
98.69
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
92.52
Supplementary Information
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