Name: tert-butyl 8-ethyl-9-phenyl-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylate
SMILES:
CCN1CC2(CCN(C(=O)OC(C)(C)C)CC2)OCC1c1ccccc1Molecular Processing
Molecular formula
C21H32N2O3
Molecular weight
360.5
Exact mass
360.2413
XLogP
3.85
TPSA
42.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
102.15
Supplementary Information
Details werden geladen…
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