Nom: (RS)-2-{1-[Bis(4-chlorophenyl)methyl]-azetidin-3-yl}-2-(3,5-difluorophenyl)-N-propylacetamide
SMILES:
CCCNC(=O)C(c1cc(F)cc(F)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1Molecular Processing
Molecular formula
C27H26Cl2F2N2O
Molecular weight
503.42
Exact mass
502.139
XLogP
6.6
TPSA
32.34
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
132.21
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→