3-{2-[4-(6-Fluoro-1,2-Benzoxazol-3-Yl)-1-Piperidinyl]Ethyl}-7-Hydroxy-2-Methyl-6,7,8,9-Tetrahydro-4H-Pyrido[1,2-a]Pyrimidin-4-One
[CAS# 147663-04-5]

Identification

• Name: 3-{2-[4-(6-Fluoro-1,2-Benzoxazol-3-Yl)-1-Piperidinyl]Ethyl}-7-Hydroxy-2-Methyl-6,7,8,9-Tetrahydro-4H-Pyrido[1,2-a]Pyrimidin-4-One
• Synonyms: 3-{2-[4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PIPERIDIN-1-YL]ETHYL}-7-HYDROXY-2-METHYL-6,7,8,9-TETRAHYDRO-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE; 7-Hydroxy Risperidone
• Molecular Formula: C₂₃H₂₇FN₄O₃
• Molecular Weight: 426.48
• CAS Registry Number: 147663-04-5
• SMILES: O=C/1N5/C(=N\C(=C\1CCN4CCC(c3noc2cc(F)ccc23)CC4)C)CCC(O)C5
• InChI: 1S/C23H27FN4O3/c1-14-18(23(30)28-13-17(29)3-5-21(28)25-14)8-11-27-9-6-15(7-10-27)22-19-4-2-16(24)12-20(19)31-26-22/h2,4,12,15,17,29H,3,5-11,13H2,1H3
• InChIKey: ABWPQNZPAOAQSG-UHFFFAOYSA-N

Properties

• Density: 1.45g/cm³ (Cal.)
• Boiling point: 612.32°C at 760 mmHg (Cal.)
• Flash point: 324.12°C (Cal.)
• Refractive index: 1.691 (Cal.)