CC(C)(C)OC(=O)[C@H]1CC(CC(=O)O)CN[C@@H]1C(=O)N1CCC(c2ccccc2)C1
SMILES: CC(C)(C)OC(=O)[C@H]1CC(CC(=O)O)CN[C@@H]1C(=O)N1CCC(c2ccccc2)C1

Molecular Processing

Molecular formula
C23H32N2O5
Molecular weight
416.52
Exact mass
416.2311
XLogP
2.41
TPSA
95.94
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.609
Molar refractivity
111.87

Supplementary Information

Récupération des détails…

Impliqué dans 2 réactions