N-(tert-butoxycarbonyl)-3,4-bis(2,6-dichlorobenzyloxy)-L-phenylalanine methyl ester

HCID 54530255
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Basic information

Standard SMILES
COC(=O)[C@H](Cc1ccc(OCc2c(Cl)cccc2Cl)c(OCc2c(Cl)cccc2Cl)c1)NC(=O)OC(C)(C)C
InChIKey
YWADICIFRDFJIE-DEOSSOPVSA-N
Molecular formula
C29H29Cl4NO6
Average molar mass
629.3 g/mol

Names & identifiers

Preferred name
N-(tert-butoxycarbonyl)-3,4-bis(2,6-dichlorobenzyloxy)-L-phenylalanine methyl ester
IUPAC
methyl (2S)-3-[3,4-bis[(2,6-dichlorophenyl)methoxy]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Names & synonyms

SCHEMBL5786228YWADICIFRDFJIE-DEOSSOPVSA-NN-(tert-butoxycarbonyl)-3,4-bis(2,6-dichlorobenzyloxy)-L-phenylalanine methyl ester

Database identifiers

PubChem CID
54530255

Properties

Computed structural properties

XLogP
8.3
Topological polar surface area
83.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
13
Heavy atoms
40

Related reactions

2 records
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Compound notes

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