Cn1c(C(F)(F)F)cc(=O)n(-c2cc(S([NH-])(=O)=O)c(Cl)cc2F)c1=O
SMILES: Cn1c(C(F)(F)F)cc(=O)n(-c2cc(S([NH-])(=O)=O)c(Cl)cc2F)c1=O

Molecular Processing

Molecular formula
C12H7ClF4N3O4S-
Molecular weight
400.72
Exact mass
399.9787
XLogP
2.09
TPSA
101.94
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
-1
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
78.76

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt