이름: (R)-quinuclidin-3-yl 2-(4-methoxybenzylamino)-2-phenylacetate
SMILES:
COc1ccc(CNC(C(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)cc1Molecular Processing
Molecular formula
C23H28N2O3
Molecular weight
380.49
Exact mass
380.21
XLogP
3.16
TPSA
50.8
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
108.06
Supplementary Information
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