名称: (R)-5-[2-(S)-amino-3-(3,5-difluorophenyl)-1-(S)-hydroxypropyl]-2-(R)-hydroxymethylmorpholine-4-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1C[C@H](CO)OC[C@@H]1[C@@H](O)[C@@H](N)Cc1cc(F)cc(F)c1Molecular Processing
Molecular formula
C19H28F2N2O5
Molecular weight
402.44
Exact mass
402.1966
XLogP
1.19
TPSA
105.25
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
28
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
97.6
Supplementary Information
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