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Basic information
- CAS
40255-57-0- Standard SMILES
Cl.OCCOC1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1- InChIKey
QWXKHVDQVSGSIQ-UHFFFAOYSA-N- Molecular formula
- C23H28ClF3N2O2S
- Average molar mass
- 489 g/mol
- Monoisotopic mass
- 488.15121148
Names & identifiers
- Preferred name
- Ethanol, 2-((1-(3-(2-(trifluoromethyl)-10H-phenothiazin-10-yl)propyl)-4-piperidinyl)oxy)-, hydrochloride (1:1)
- IUPAC
- 2-[1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidin-4-yl]oxyethanol;hydrochloride
Names & synonyms
40255-57-0Ethanol, 2-((1-(3-(2-(trifluoromethyl)-10H-phenothiazin-10-yl)propyl)-4-piperidinyl)oxy)-, monohydrochlorideDTXSID50193234RefChem:1084453DTXCID60115725Ethanol, 2-((1-(3-(2-(trifluoromethyl)-10H-phenothiazin-10-yl)propyl)-4-piperidinyl)oxy)-, hydrochloride (1:1)10-(3-(4-(beta-Hydroxyethoxy)piperidino)propyl)-2-trifluoromethyl-phenothiazine hydrochlorideSCHEMBL1168445910-[3-(4-beta-hydroxyethoxypiperidino) propyl]-2-trifluoromethyl-phenothiazine hydrochloride2-[(1-{3-[2-(Trifluoromethyl)-10H-phenothiazin-10-yl]propyl}piperidin-4-yl)oxy]ethan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
40255-57-0- PubChem CID
- 218088
- DTXSID
DTXSID50193234
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 61.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 559
Related reactions
1 records
Compound notes
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