الاسم: (±)-cis-N1,N2-Bis(benzyloxycarbonyl)-4-oxo-1,2-cyclohexanediamine
SMILES:
O=C1CC[C@@H](NC(=O)OCc2ccccc2)[C@@H](NC(=O)OCc2ccccc2)C1Molecular Processing
Molecular formula
C22H24N2O5
Molecular weight
396.44
Exact mass
396.1685
XLogP
3.33
TPSA
93.73
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
105.96
Supplementary Information
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