Aitheantas

Pha-543613

Gan liostú · C15H17N3O2

01Aitheantas

Lazychem IDLC-81593
CAS RNGan liostú
PubChem CID9930121
Molecular formulaC15H17N3O2
Molecular weight271.31 g/mol
IUPAC nameN-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide
InChIKeyIPKZCLGGYKRDES-ZDUSSCGKSA-N

02Struchtúr agus steiréicheimic

2D structurePubChem CID 9930121
Two-dimensional chemical structure of Pha-543613
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count5
Secondary amines0
Tertiary amines1
SMILESC1CN2CCC1[C@H](C2)NC(=O)C3=NC=C4C(=C3)C=CO4
InChIGan liostú

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Stádas san India

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

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