CN(C)C(=O)OCC1c2cn[nH]c2CCN1S(=O)(=O)c1ccc(Cl)cc1
SMILES: CN(C)C(=O)OCC1c2cn[nH]c2CCN1S(=O)(=O)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C16H19ClN4O4S
Molecular weight
398.87
Exact mass
398.0816
XLogP
2.05
TPSA
95.6
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
95.41

Supplementary Information

Récupération des détails…

Impliqué dans 2 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→