Nombre: solution
SMILES:
Cn1ccc(C(=O)N[C@@H]2CC[C@H](c3ccc(Cl)c(Cl)c3)c3ccccc32)c(O)c1=OMolecular Processing
Molecular formula
C23H20Cl2N2O3
Molecular weight
443.33
Exact mass
442.0851
XLogP
4.79
TPSA
71.33
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
117.54
Supplementary Information
Obteniendo detalles…
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