(S)-3-Benzyloxycarbonylamino-4-oxo-5-(2,3,5,6-tetrafluoro-phenoxy)-pentanoic Acid Tert-Butyl Ester

HCID 57725369
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Basic information

Standard SMILES
CC(C)(C)OC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)COc1c(F)c(F)cc(F)c1F
InChIKey
MRTGTFBFDWLFNS-INIZCTEOSA-N
Molecular formula
C23H23F4NO6
Average molar mass
485.4 g/mol

Names & identifiers

Preferred name
(S)-3-Benzyloxycarbonylamino-4-oxo-5-(2,3,5,6-tetrafluoro-phenoxy)-pentanoic Acid Tert-Butyl Ester
IUPAC
tert-butyl (3S)-4-oxo-3-(phenylmethoxycarbonylamino)-5-(2,3,5,6-tetrafluorophenoxy)pentanoate

Names & synonyms

SCHEMBL78880MRTGTFBFDWLFNS-INIZCTEOSA-N(S)-3-Benzyloxycarbonylamino-4-oxo-5-(2,3,5,6-tetrafluoro-phenoxy)-pentanoic Acid Tert-Butyl Ester

Database identifiers

PubChem CID
57725369

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
90.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
10
Rotatable bonds
12
Heavy atoms
34

Related reactions

4 records
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Compound notes

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