Name: 1,1-dimethylethyl (2R,5S)-2-(aminocarbonyl)-5-(4-{[(2-fluorophenyl)methyl]oxy}phenyl)-1-pyrrolidinecarboxylate
SMILES:
CC(C)(C)OC(=O)N1[C@@H](C(N)=O)CC[C@H]1c1ccc(OCc2ccccc2F)cc1Molecular Processing
Molecular formula
C23H27FN2O4
Molecular weight
414.48
Exact mass
414.1955
XLogP
4.33
TPSA
81.86
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
110.2
Supplementary Information
Details werden geladen…
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