Identitet

Risperidone Impurity 47

Nije navedeno · C23H29FN4O3

01Identitet

Lazychem ID	LC-47905
CAS RN	Nije navedeno
PubChem CID	9910449
Molecular formula	C23H29FN4O3
Molecular weight	428.5 g/mol
IUPAC name	3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-2,3,6,7,8,9-hexahydropyrido[1,2-a]pyrimidin-4-one
InChIKey	KZYCUMMUAIJCRI-UHFFFAOYSA-N

02Struktura i stereokemija

Two-dimensional chemical structure of Risperidone Impurity 47 — 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, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	5
Secondary amines	0
Tertiary amines	1

SMILES	CC1C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
InChI	Nije navedeno

03Stereochemistry

The published structure contains 0 defined and 3 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres3Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 8Before 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.