Nom: 4-[2-(4-chloro-2-hydroxy-phenyl)-benzoimidazol-1-ylmethyl]-3-fluoro-benzonitrile
SMILES:
N#Cc1ccc(Cn2c(-c3ccc(Cl)cc3O)nc3ccccc32)c(F)c1Molecular Processing
Molecular formula
C21H13ClFN3O
Molecular weight
377.81
Exact mass
377.0731
XLogP
5.12
TPSA
61.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.048
Molar refractivity
102.06
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→