10-(3-(4-(2-Hydroxyethyl)-1-piperazinyl)propyl)-8-(trifluoromethyl)-10H-phenothiazin-3-ol
Basic information
- CAS
33098-48-5- Standard SMILES
OCCN1CCN(CCCN2c3ccc(O)cc3Sc3ccc(C(F)(F)F)cc32)CC1- InChIKey
XVCSDQAFEIGVBC-UHFFFAOYSA-N- Molecular formula
- C22H26F3N3O2S
- Average molar mass
- 453.5 g/mol
- Monoisotopic mass
- 453.16978274
Overview
7-hydroxyfluphenazine is a member of phenothiazines.
Names & identifiers
- Preferred name
- 10-(3-(4-(2-Hydroxyethyl)-1-piperazinyl)propyl)-8-(trifluoromethyl)-10H-phenothiazin-3-ol
- IUPAC
- 10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(trifluoromethyl)phenothiazin-3-ol
- English name
- 7-hydroxyfluphenazine
- Molecular formula
- C22H26F3N3O2S
- Molecular weight
- 453.52
Names & synonyms
7-Hydroxyfluphenazine33098-48-57-OhfluDTXSID4018675610H-Phenothiazin-3-ol, 10-(3-(4-(2-hydroxyethyl)-1-piperazinyl)propyl)-8-(trifluoromethyl)-RefChem:907885DTXCID8010924710-(3-(4-(2-Hydroxyethyl)-1-piperazinyl)propyl)-8-(trifluoromethyl)-10H-phenothiazin-3-ol7-Hydroxy Fluphenazine10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(trifluoromethyl)phenothiazin-3-olXVCSDQAFEIGVBC-UHFFFAOYSA-NCHEBI:184014
Show more names
10-[3-[4-(2-Hydroxyethyl)-1-piperazinyl]propyl]-8-(trifluoroMethyl)-4-[3-[2-(Trifluoromethyl)-7-hydroxy-10H-phenothiazin-10-yl]propyl]-1-piperazineethanol10-[3-[4-(2-Hydroxyethyl)-1-piperazinyl]propyl]-8-(trifluoromethyl)-10H-phenothiazin-3-ol10H-Phenothiazin-3-ol, 10-[3-[4-(2-hydroxyethyl)-1-piperazinyl]propyl]-8-(trifluoromethyl)-
MFCD00869516AKOS03024003710-{3-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]PROPYL}-8-(TRIFLUOROMETHYL)-10H-PHENOTHIAZIN-3-OLDB-21592510-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(triluoromethyl)phenothiazin-3-ol
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 75.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 577
Physicochemical properties
- Melting point
- 164 · 164-166°C
- Boiling point
- 270 · 270-280 °C(Press: 0.01 Torr)
- Density
- 1.324 · 1.324±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer, Under Inert Atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 9.34 · 9.34±0.20(Predicted)
- color
- Pale Brown to Very Dark Red
Chemistry & industry
Applications
UsesA metabolite of Fluphenazine (F598400).
Additional notes
DefinitionChEBI: 7-hydroxyfluphenazine is a member of phenothiazines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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