(S)-tert-butyl 2-(5-(4-iodophenyl)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate

HCID 59345147
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC[C@H]1c1nnc(-c2ccc(I)cc2)o1
InChIKey
KHZOVIIVBLXEBX-ZDUSSCGKSA-N
Molecular formula
C17H20IN3O3
Average molar mass
441.26 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL889018KHZOVIIVBLXEBX-ZDUSSCGKSA-N(S)-tert-butyl 2-(5-(4-iodophenyl)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate

Database identifiers

PubChem CID
59345147

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
68.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
24

Related reactions

1 records
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Linked notes

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