SMILES:
CCc1ccc(-c2cc(NC(=O)c3cccnc3)cnc2OCC(F)(F)F)cc1Molecular Processing
Molecular formula
C21H18F3N3O2
Molecular weight
401.39
Exact mass
401.1351
XLogP
4.9
TPSA
64.11
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
102.79
Supplementary Information
Obteniendo detalles…
Participa en 2 reacciones→