(S)-t-Butyl 2-(5-((3,4-dimethoxyphenoxy)methyl)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate

HCID 86706751
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Basic information

Standard SMILES
COc1ccc(OCc2nnc([C@@H]3CCCN3C(=O)OC(C)(C)C)o2)cc1OC
InChIKey
UPXSWMWQKSONEV-AWEZNQCLSA-N
Molecular formula
C20H27N3O6
Average molar mass
405.4 g/mol

Names & identifiers

Preferred name
(S)-t-Butyl 2-(5-((3,4-dimethoxyphenoxy)methyl)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
IUPAC
tert-butyl (2S)-2-[5-[(3,4-dimethoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate

Names & synonyms

SCHEMBL17243774UPXSWMWQKSONEV-AWEZNQCLSA-N(S)-t-Butyl 2-(5-((3,4-dimethoxyphenoxy)methyl)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate

Database identifiers

PubChem CID
86706751

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
96.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

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