OCc1cnc(Nc2cccc(Cl)c2)nc1C(F)(F)F
SMILES: OCc1cnc(Nc2cccc(Cl)c2)nc1C(F)(F)F

Molecular Processing

Molecular formula
C12H9ClF3N3O
Molecular weight
303.67
Exact mass
303.0386
XLogP
3.38
TPSA
58.04
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
67.69

Supplementary Information

Récupération des détails…

Impliqué dans 4 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→