名称: (2R,5R)-5-[(1S,2S)-2-amino-3-(3,5-difluorophenyl)-1-hydroxypropyl]-2-cyclohexyloxymethylmorpholine-4-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1C[C@H](COC2CCCCC2)OC[C@@H]1[C@@H](O)[C@@H](N)Cc1cc(F)cc(F)c1Molecular Processing
Molecular formula
C25H38F2N2O5
Molecular weight
484.58
Exact mass
484.2749
XLogP
3.55
TPSA
94.25
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
34
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.72
Molar refractivity
123.34
Supplementary Information
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