CCCN1CCC(C#N)(NC(=O)C(CC2CCCCC2)NC2=NS(=O)(=O)c3ccccc32)CC1
SMILES: CCCN1CCC(C#N)(NC(=O)C(CC2CCCCC2)NC2=NS(=O)(=O)c3ccccc32)CC1

Molecular Processing

Molecular formula
C25H35N5O3S
Molecular weight
485.65
Exact mass
485.2461
XLogP
2.95
TPSA
114.66
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.64
Molar refractivity
130.73

Supplementary Information

Récupération des détails…

Impliqué dans 9 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→