Nom: N-[5-(1-aminoethyl) -2-fluorophenyl]acetamide
SMILES:
CC(C)Oc1cc(Nc2nc(N[C@@H](C)c3ccc(F)cc3)c([N+](=O)[O-])cc2F)n[nH]1Molecular Processing
Molecular formula
C19H20F2N6O3
Molecular weight
418.4
Exact mass
418.1565
XLogP
4.7
TPSA
118
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
106.92
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→