Betazole - CAS 105-20-4
Catalog: |
BB001576 |
Product Name: |
Betazole |
CAS: |
105-20-4 |
Synonyms: |
Ametazole; 1H-Pyrazole-3-ethanamine; 3-(2-Aminoethyl)pyrazole; 2-(3-Pyrazolyl)ethanamine; 2-(3-Pyrazolyl)ethylamine; Histalog; 2-(1H-Pyrazol-3-yl)ethanamine; 3-(beta-aminoethyl)pyrazole; 3-(2-Aminoethyl)-1H-pyrazole; 3-(β-Aminoethyl)pyrazole |
Application: |
Histamine Agonists |
Related CAS: | 138-92-1 (dihydrochloride)
|
IUPAC Name: | 2-(1H-pyrazol-5-yl)ethanamine |
Description: | Betazole, an orally active histamine H2 receptor agonist with diagnostic application, is clinically used to detect gastric secretory function. It induces gastric acid secretion and causes an immediate and significant increase in common bile duct pressure. |
Molecular Weight: | 111.15 |
Molecular Formula: | C5H9N3 |
Canonical SMILES: | C1=C(NN=C1)CCN |
InChI: | InChI=1S/C5H9N3/c6-3-1-5-2-4-7-8-5/h2,4H,1,3,6H2,(H,7,8) |
InChI Key: | JXDFEQONERDKSS-UHFFFAOYSA-N |
Boiling Point: | 284.1±15.0°C at 760 mmHg |
Melting Point: | 25°C |
Purity: | ≥96% |
Density: | 1.1±0.1 g/cm3 |
Solubility: | Soluble in DMSO |
Appearance: | Solid Powder |
Storage: | Store at 2-8°C, protect from light |
LogP: | 0.61120 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10980756-B1 | Methods of treatment | 20200316 |
WO-2021188564-A1 | Methods of treating covid-19 with a niclosamide compound | 20200316 |
WO-2021183896-A1 | Methods of modulating gastrointestinal microbial metabolic pathways and metabolites | 20200313 |
CN-111233766-A | Naphthalene ring-pyrazole compound and preparation method and application thereof | 20200210 |
WO-2021108427-A1 | Excipient compounds for biopolymer formulations | 20191126 |
PMID | Publication Date | Title | Journal |
19302218 | 20090101 | Gastric secretory and hormonal patterns in end-stage chagasic achalasia | Diseases of the esophagus : official journal of the International Society for Diseases of the Esophagus |
15075465 | 20031201 | Gastric analysis with fractional test meals (ethanol, caffeine, and peptone meal), augmented histamine or pentagastrin tests, and gastric pH recording | Journal of physiology and pharmacology : an official journal of the Polish Physiological Society |
Complexity: | 64.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 111.079647300 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 111.079647300 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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