Dixyrazine
Basic information
- CAS
2470-73-7- Standard SMILES
CC(CN1CCN(CCOCCO)CC1)CN1c2ccccc2Sc2ccccc21- InChIKey
MSYUMPGNGDNTIQ-UHFFFAOYSA-N- Molecular formula
- C24H33N3O2S
- Average molar mass
- 427.6 g/mol
- Monoisotopic mass
- 427.22934848
Overview
Dixyrazine is a member of phenothiazines.
Names & identifiers
- Preferred name
- Dixyrazine
- IUPAC
- 2-[2-[4-(2-methyl-3-phenothiazin-10-ylpropyl)piperazin-1-yl]ethoxy]ethanol
- English name
- 2-[2-[4-[2-methyl-3-(10H-phenothiazin-10-yl)propyl]piperazin-1-yl]ethoxy]ethanol
- Molecular formula
- C24H33N3O2S
- Molecular weight
- 427.6
Names & synonyms
Dixyrazine2470-73-7EsucosDyxirazineUCB-34127H368W3AYCJ21.394BDTXSID109476392-[2-[4-[2-METHYL-3-(10H-PHENOTHIAZIN-10-YL)PROPYL]PIPERAZIN-1-YL]ETHOXY]ETHANOL2-(2-(4-(2-Methyl-3-(10H-phenothiazin-10-yl)propyl)piperazin-1-yl)ethoxy)ethanolETHANOL, 2-(2-(4-(2-METHYL-3-PHENOTHIAZIN-10-YLPROPYL)-1-PIPERAZINYL)ETHOXY)-Ethanol, 2-[2-[4-(2-methyl-3-phenothiazin-10-ylpropyl)-1-piperazinyl]ethoxy]-
Show more names
Dixyrazine, 10 mM in DMSO2-[2-[4-(2-methyl-3-phenothiazin-10-yl-propyl)piperazin-1-yl]ethoxy]ethanol2-[2-[4-[2-Methyl-3-(10H-phenothiazin-10-yl)propyl]-1-piperazinyl]ethoxy]ethanol2-(2-(4-(2-Methyl-3-(10H-phenothiazin-10-yl)propyl)piperazin-1-yl)ethoxy)ethan-1-ol
RefChem:13528010-(2-methyl 3-(1-hydroxyethoxyethyl-4-piperazinyl)propyl)phenothiazineDTXCID4013758962-(2-(4-(2-((10H-phenothiazin-10-yl)methyl)propyl)piperazin-1-yl)ethoxy)ethan-1-ol219-591-32-[2-[4-(2-methyl-3-phenothiazin-10-ylpropyl)piperazin-1-yl]ethoxy]ethanolEthanol,2-[2-[4-[2-methyl-3-(10H-phenothiazin-10-yl)propyl]-1-piperazinyl]ethoxy]-UCB 3412
Database identifiers
- CAS
2470-73-7- PubChem CID
- 17182
- DTXSID
DTXSID10947639- ChEMBL
CHEMBL3275586- ChEBI
CHEBI:135695- UNII
- 7H368W3AYC
- EC Number
- 219-591-3
- Nikkaji
- J21.394B
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 481
Experimental & physicochemical properties
LogP4.42
Human DrugsPharmaceuticals
Collision Cross Section201 Ų [M+H]+ [CCS Type: TW; Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Physicochemical properties
- Melting point
- 192 °C · 192 °C
- Boiling point
- 590 · 590.0±50.0 °C(Predicted)
- Density
- 1.0745 · 1.0745 (rough estimate)
- refractive index
- 1.674 · 1.6740 (estimate)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- form
- Solid
- pka
- 1 · pKa1: 7.8; pKa2: 3.65(at 25℃)
- color
- White to off-white
- FDA UNII
- 7 H368W3AYC · 7H368W3AYC
- ATC code
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Pharmacology
ATC Code
N - Nervous system
QN - Nervous system
MeSH Pharmacological Classification
Drugs used to prevent NAUSEA or VOMITING.
Agents that control agitated psychotic behavior, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect. They are used in SCHIZOPHRENIA; senile dementia; transient psychosis following surgery; or MYOCARDIAL INFARCTION; etc. These drugs are often referred to as neuroleptics alluding to the tendency to produce neurological side effects, but not all antipsychotics are likely to produce such effects. Many of these drugs may also be effective against nausea, emesis, and pruritus.
A subclass of analgesic agents that typically do not bind to OPIOID RECEPTORS and are not addictive. Many non-narcotic analgesics are offered as NONPRESCRIPTION DRUGS.
Uses & manufacturing
Use ClassificationPharmaceuticals
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Dixyrazine is a member of phenothiazines.
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Compound notes
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