Name: (1S,5R)-1-[2-fluoro-4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hexane
SMILES:
Fc1cc(C(F)(F)F)ccc1[C@@]12CNC[C@@H]1C2Molecular Processing
Molecular formula
C12H11F4N
Molecular weight
245.22
Exact mass
245.0828
XLogP
2.71
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
54.06
Supplementary Information
Details werden geladen…
An 9 Reaktionen beteiligt→