이름: Tert-butyl 8-benzyl-9,9-dimethyl-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC2(CC1)CN(Cc1ccccc1)C(C)(C)CO2Molecular Processing
Molecular formula
C22H34N2O3
Molecular weight
374.53
Exact mass
374.2569
XLogP
4.07
TPSA
42.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.682
Molar refractivity
106.66
Supplementary Information
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