Nom: 7-iodo-2-(4-isopropylsulfonylphenyl)-5H-pyrrolo[2,3-b]pyrazine
SMILES:
CC(C)S(=O)(=O)c1ccc(-c2cnc3[nH]cc(I)c3n2)cc1Molecular Processing
Molecular formula
C15H14IN3O2S
Molecular weight
427.27
Exact mass
426.9851
XLogP
3.41
TPSA
75.71
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
94.36
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→