Cc1ccc(S(=O)(=O)N2CCNCCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1
Nom: N,N'-bis(p-toluenesulfonyl)-1,4,7-triazacyclononane
SMILES: Cc1ccc(S(=O)(=O)N2CCNCCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1

Molecular Processing

Molecular formula
C20H27N3O4S2
Molecular weight
437.59
Exact mass
437.1443
XLogP
1.59
TPSA
86.79
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
112.75

Supplementary Information

Récupération des détails…

Impliqué dans 8 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→