2-(3-(4-(4-Fluorophenyl)-1-piperazinyl)propyl)-2H-naphth(1,8-cd)isothiazole 1,1-dioxide
[CAS# 127625-29-0]

Identification

• Name: 2-(3-(4-(4-Fluorophenyl)-1-piperazinyl)propyl)-2H-naphth(1,8-cd)isothiazole 1,1-dioxide
• Synonyms: Fananserin (Usan); 2-(3-(4-(P-Fluorophenyl)-1-Piperazinyl)Propyl)-2H-Naphth(1,8-Cd)Isothiazole 1,1-Dioxide; 2H-Naphth(1,8-Cd)Isothiazole, 2-(3-(4-(4-Fluorophenyl)-1-Piperazinyl)Propyl)-, 1,1-Dioxide
• Molecular Formula: C₂₃H₂₄FN₃O₂S
• Molecular Weight: 425.52
• CAS Registry Number: 127625-29-0
• SMILES: C1=CC=C5C4=C1N(CCCN3CCN(C2=CC=C(C=C2)F)CC3)[S](C4=CC=C5)(=O)=O
• InChI: 1S/C23H24FN3O2S/c24-19-8-10-20(11-9-19)26-16-14-25(15-17-26)12-3-13-27-21-6-1-4-18-5-2-7-22(23(18)21)30(27,28)29/h1-2,4-11H,3,12-17H2
• InChIKey: VGIGHGMPMUCLIQ-UHFFFAOYSA-N

Properties

• Density: 1.331g/cm³ (Cal.)
• Boiling point: 641.125°C at 760 mmHg (Cal.)
• Flash point: 341.54°C (Cal.)
• solubility: Soluble to 100 mM in DMSO