Nom: 3-(4-chlorophenyl)-2(S)-(3-cyanophenyl)-1(S)-methyl-propylamine hydrochloride
SMILES:
C[C@H](N)[C@@H](Cc1ccc(Cl)cc1)c1cccc(C#N)c1.ClMolecular Processing
Molecular formula
C17H18Cl2N2
Molecular weight
321.25
Exact mass
320.0847
XLogP
4.31
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.235
Molar refractivity
89.95
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→