Nom: title compound
SMILES:
Cc1cc(-c2c(C)c(CN3CCOCC3)n3ncnc(N)c23)ccc1NC(=O)Nc1cc(C(F)(F)F)ccc1FMolecular Processing
Molecular formula
C27H27F4N7O2
Molecular weight
557.55
Exact mass
557.2162
XLogP
5.23
TPSA
109.81
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
40
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
142.45
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→