Nom: 5-amino-1-(2-fluoro-4-methanesulfonyl-phenyl)-1H-pyrazole-4-carbonitrile
SMILES:
CS(=O)(=O)c1ccc(-n2ncc(C#N)c2N)c(F)c1Molecular Processing
Molecular formula
C11H9FN4O2S
Molecular weight
280.28
Exact mass
280.043
XLogP
0.87
TPSA
101.77
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
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
0.091
Molar refractivity
65.76
Supplementary Information
Récupération des détails…
Impliqué dans 5 réactions→