Name: methyl cis(±)-3-(4-amino-3-methoxypiperidin-1-yl)-5-methoxybenzoate
SMILES:
COC(=O)c1cc(OC)cc(N2CC[C@H](N)[C@H](OC)C2)c1Molecular Processing
Molecular formula
C15H22N2O4
Molecular weight
294.35
Exact mass
294.158
XLogP
1.03
TPSA
74.02
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
79.94
Supplementary Information
Details werden geladen…
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