Nombre: 10-(4-tert-butyl-phenyl)-1,4-dioxa-10-aza-dispiro[4.2.4.2]tetradecan-9-one
SMILES:
CC(C)(C)c1ccc(N2CCC3(CCC4(CC3)OCCO4)C2=O)cc1Molecular Processing
Molecular formula
C21H29NO3
Molecular weight
343.47
Exact mass
343.2147
XLogP
4.02
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
25
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
97.65
Supplementary Information
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