Name: tert-butyl 7-benzyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CC2CN(Cc3ccccc3)CC(C1)O2Molecular Processing
Molecular formula
C18H26N2O3
Molecular weight
318.42
Exact mass
318.1943
XLogP
2.51
TPSA
42.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
88.19
Supplementary Information
Details werden geladen…
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