CC(C)(C(N)=O)N1CCN(Cc2cc3nc(Cl)nc(N4CCOCC4)c3s2)CC1
SMILES: CC(C)(C(N)=O)N1CCN(Cc2cc3nc(Cl)nc(N4CCOCC4)c3s2)CC1

Molecular Processing

Molecular formula
C19H27ClN6O2S
Molecular weight
438.99
Exact mass
438.1605
XLogP
1.56
TPSA
87.82
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
115.58

Supplementary Information

Récupération des détails…

Impliqué dans 23 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→