名称: 1-[3-(4-cyanophenoxy)propyl]-4diphenylmethoxypiperidine
SMILES:
N#Cc1ccc(OCCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1Molecular Processing
Molecular formula
C28H30N2O2
Molecular weight
426.56
Exact mass
426.2307
XLogP
5.6
TPSA
45.49
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
126.54
Supplementary Information
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