(2S,4R)-2-benzooxazol-2-yl-4-tert-butoxy-pyrrolidine-1-carboxylic acid benzyl ester

HCID 89768034
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Basic information

Standard SMILES
CC(C)(C)O[C@@H]1C[C@@H](c2nc3ccccc3o2)N(C(=O)OCc2ccccc2)C1
InChIKey
VTRGJDSQUBURDB-MJGOQNOKSA-N
Molecular formula
C23H26N2O4
Average molar mass
394.5 g/mol

Names & identifiers

Preferred name
(2S,4R)-2-benzooxazol-2-yl-4-tert-butoxy-pyrrolidine-1-carboxylic acid benzyl ester
IUPAC
benzyl (2S,4R)-2-(1,3-benzoxazol-2-yl)-4-[(2-methylpropan-2-yl)oxy]pyrrolidine-1-carboxylate

Names & synonyms

SCHEMBL15211528VTRGJDSQUBURDB-MJGOQNOKSA-N(2S,4R)-2-benzooxazol-2-yl-4-tert-butoxy-pyrrolidine-1-carboxylic acid benzyl ester

Database identifiers

PubChem CID
89768034

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
64.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
29

Related reactions

4 records
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Compound notes

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