SMILES:
CSc1ccc(-c2cc(C(F)(F)F)nc(SC)n2)cc1Molecular Processing
Molecular formula
C13H11F3N2S2
Molecular weight
316.37
Exact mass
316.0316
XLogP
4.61
TPSA
25.78
H-bond donors
0
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
7
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
76.03
Supplementary Information
Récupération des détails…
Impliqué dans 8 réactions→