Completing data — usually done within a minute
Basic information
- Standard SMILES
CCCn1c(=O)[nH]c(=O)c2[nH]cnc21- InChIKey
SIQPXVQCUCHWDI-UHFFFAOYSA-N- Molecular formula
- C8H10N4O2
- Average molar mass
- 194.194 g/mol
- Monoisotopic mass
- 194.08037556
Names & identifiers
- Preferred name
- Enprofylline
- IUPAC
- 3-Propyl-3,7-dihydro-1H-purine-2,6-dione
- English name
- ENPROFYLLINE
- Molecular formula
- C8H10N4O2
- Molecular weight
- 194.19
Names & synonyms
Database identifiers
- CAS
41078-02-8- PubChem CID
- 1676
- DTXSID
DTXSID9045186- ChEMBL
CHEMBL279898- ChEBI
CHEBI:126237- UNII
- DT7DT5E518
- EC Number
- 255-201-8
- Nikkaji
- J16.542E
Properties
Physicochemical properties
- Melting point
- 287 · 287-289 °C
- Density
- 1.38 g/cm3 · 1.38 g/cm3
- storage temp.
- 2 · 2-8°C
- solubility
- DMSO: soluble
- form
- solid
- pka
- 10.26 · 10.26±0.20(Predicted)
- color
- white
- CAS DataBase Reference
- 41078 · 41078-02-8
- FDA UNII
- 7 DT5E518 · DT7DT5E518
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 332 · H332-H302-H312
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22
- Safety Statements
- 36 · 36
- WGK Germany
- 3 · 3
- RTECS
- 8439700 · UO8439700
Safety & regulation
Safety data
- wgk
- 3
- rtecs
- UO8439700
- risk_code
- 20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 36
- Hazard statements
- H332-H302-H312
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
Description3-Propylxanthine is a xanthine derivative that antagonizes adenosine receptors (Kis = 44, 32, and 6.3 μM for A1, A2A, and A2B, respectively) and cAMP phosphodiesterase (Ki = 42 μM). Through these actions, 3-propylxanthine induces smooth muscle relaxation, blocks smooth muscle contraction and VEGF secretion driven by adenosine receptor agonists, and reduces bronchial hyperresponsiveness.
UsesBronchodilator.
UsesEnprofylline is a xanthine lacking adenosine receptor antagonism.
Upstream & downstream products
Upstream raw materials
Suppliers27 total
Additional notes
DefinitionChEBI: Xanthine bearing a propyl substituent at position 3. A bronchodilator, it is used for the symptomatic treatment of asthma and chronic obstructive pulmonary disease, and in the management of cerebrovascular insufficiency, sickle cell disease, and diabetic n uropathy.
Related reactions
Linked notes
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