Nom: dimethyl(2S,3S,5S)-5-(3-fluorophenoxy)-2-[(4-phenylpiperazin-1-yl)carbonyl]piperidine-1,3-dicarboxylate
SMILES:
COC(=O)[C@H]1C[C@H](Oc2cccc(F)c2)CN(C(=O)OC)[C@@H]1C(=O)N1CCN(c2ccccc2)CC1Molecular Processing
Molecular formula
C26H30FN3O6
Molecular weight
499.54
Exact mass
499.2119
XLogP
2.55
TPSA
88.62
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
36
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
129.07
Supplementary Information
Récupération des détails…
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