이름: (R)—((R)-quinuclidin-3-yl) 2-phenyl-2-(phenylamino)acetate
SMILES:
O=C(O[C@H]1CN2CCC1CC2)[C@H](Nc1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C21H24N2O2
Molecular weight
336.44
Exact mass
336.1838
XLogP
3.48
TPSA
41.57
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
25
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
98.29
Supplementary Information
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