SMILES:
Cc1ccc(-c2nc(C(F)(F)F)cn2-c2ccc(S(N)(=O)=O)cc2)cc1ClMolecular Processing
Molecular formula
C17H13ClF3N3O2S
Molecular weight
415.82
Exact mass
415.0369
XLogP
4.17
TPSA
77.98
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
95.12
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→