이름: Tert-butyl 10-ethyl-8-(2-pyridyl)-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylate
SMILES:
CCC1CN(c2ccccn2)CC2(CCN(C(=O)OC(C)(C)C)CC2)O1Molecular Processing
Molecular formula
C20H31N3O3
Molecular weight
361.49
Exact mass
361.2365
XLogP
3.47
TPSA
54.9
H-bond donors
0
H-bond acceptors
5
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
6
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
101.39
Supplementary Information
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