الاسم: (2S,3R)-benzyl 2-((tert-butoxycarbonyl)amino)-3-hydroxy-3-(4-methoxyphenyl)propanoate
SMILES:
COc1ccc([C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)cc1Molecular Processing
Molecular formula
C22H27NO6
Molecular weight
401.46
Exact mass
401.1838
XLogP
3.37
TPSA
94.09
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
107.35
Supplementary Information
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