Name: tert-butyl (3RS,4RS)-4-[4-(3-hydroxy-propoxy)-phenyl]-3-(naphthalen-2-ylmethoxy)-piperidine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCO)cc2)C(OCc2ccc3ccccc3c2)C1Molecular Processing
Molecular formula
C30H37NO5
Molecular weight
491.63
Exact mass
491.2672
XLogP
5.91
TPSA
68.23
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.433
Molar refractivity
141.33
Supplementary Information
Details werden geladen…
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