Repaglinide Impurity 1

01Identidade

Lazychem ID	LC-26885
CAS RN	Não indicado
PubChem CID	76576302
Molecular formula	C27H34N2O4
Molecular weight	450.6 g/mol
IUPAC name	2-Ethoxy-4-(2-(6-isobutyl-2,3,4,4a-tetrahydro-1H-pyrido[1,2-a]quinazolin-5(6H)-yl)-2-oxoethyl)benzoic acid
InChIKey	GOWJOEATHNQSEX-UHFFFAOYSA-N

02Estrutura e estereoquímica

Two-dimensional chemical structure of Repaglinide Impurity 1 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	4
Secondary amines	0
Tertiary amines	1

SMILES	O=C(O)C1=CC=C(CC(N2C(CCCC3)N3C4=C(C=CC=C4)C2CC(C)C)=O)C=C1OCC
InChI	Não indicado

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres2Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

3 records

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.

CAS not listed

GOWJOEATHNQSEX-UHFFFAOYSA-N

Current configuration

2-ethoxy-4-(2-((4aS,6S)-6-isobutyl-2,3,4,4a-tetrahydro-1H-pyrido[1,2-a]quinazolin-5(6H)-yl)-2-oxoethyl)benzoic acid

CAS 2519482-34-7

GOWJOEATHNQSEX-ZCYQVOJMSA-N

2 defined, 0 unassigned centres

Repaglinide Impurity 10

CAS 2519482-33-6

GOWJOEATHNQSEX-UKILVPOCSA-N

2 defined, 0 unassigned centres

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.

04Estado na Índia

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

05Nomes e relações

API e fármaco de origem

Repaglinide

Impurezas e compostos relacionados

Nomes e relações

06Fontes

S01
PubChem CID 76576302
Structure and machine-readable chemical identifiers.