Identidad

(R)-9-Hydroxy Risperidone

CAS 130049-85-3 · C23H27FN4O3

01Identidad

Lazychem IDLC-00637
CAS RN130049-85-3
PubChem CID9802545
Molecular formulaC23H27FN4O3
Molecular weight426.48 g/mol
IUPAC name(9R)-3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
InChIKeyPMXMIIMHBWHSKN-LJQANCHMSA-N

02Estructura y estereoquímica

2D structurePubChem CID 9802545
Two-dimensional chemical structure of (R)-9-Hydroxy Risperidone, CAS 130049-85-3
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, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count5
Secondary amines0
Tertiary amines1
SMILESCC1=C(C(=O)N2CCC[C@H](C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
InChINo indicado

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

2 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.

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 en India

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

05Nombres y relaciones

API y fármaco de origen

Risperidone; Paliperidone

Impurezas y compuestos relacionados

Nombres y relaciones

  • (R)-9-Hydroxy Risperidone / Risperidone Impurity 4
  • (R)-9-Hydroxy Risperidone
  • Risperidone Impurity 4
  • (9~{R})-3-[2-[4-(6-fluoranyl-1, 2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-9-oxidanyl-6, 7, 8, 9-tetrahydropyrido[1, 2-a]pyrimidin-4-one
  • 130049-85-3
  • (R)-paliperidone
  • (+)-9-Hydroxyrisperidone
  • Paliperidone, (R)-
  • 29F930S8Z1
  • (9R)-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
  • DTXCID2028985
  • (9R)-3-(2-(4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl)ethyl)-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido(1,2-a)pyrimidin-4-one

Impurezas y compuestos relacionados

06Fuentes