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Substance Name: Pimefylline nicotinate
RN: 10058-07-8
UNII: 8Y694512DA
InChIKey: DOWFKBHYDXGGML-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formulas
- C15-H18-N6-O2.C6-H5-N-O2
- C21-H23-N7-O4
Molecular Weight
- 437.4577
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Names and Synonyms
Name of Substance
- Pimefylline nicotinate
Synonyms
- 7-(2-((3-Pyridylmethyl)amino)ethyl)theophylline nicotinate
- 7-(2-(Piridil)-metilammino-etil)-teofillino nicotinato
- 7-(2-(Piridil)-metilammino-etil)-teofillino nicotinato [Italian]
- 7-(beta-3'-Picolylaminoaethyl)theophyllin-nicotinat
- 7-(beta-3'-Picolylaminoaethyl)theophyllin-nicotinat [German]
- EINECS 233-185-3
- ES 902
- Teonicon
- UNII-8Y694512DA
Systematic Names
- Nicotinic acid, compound with 3,7-dihydro-1,3-dimethyl-7-(2-((3-pyridylmethyl)amino)ethyl)-1H-purine-2,6-dione (1:1)
- Theophylline, 7-(2-((3-pyridylmethyl)amino)ethyl)-, nicotinate
Registry Numbers
CAS Registry Number
- 10058-07-8
FDA UNII
- 8Y694512DA
System Generated Number
- 0010058078
Molecular Formulas
Molecular Formulas
- C15-H18-N6-O2.C6-H5-N-O2
- C21-H23-N7-O4
Molecular Formula Fragments
- C15-H18-N6-O2
- C6-H5-N-O2
- COMPONENT
Structure Descriptors
InChI
1S/C15H18N6O2.C6H5NO2/c1-19-13-12(14(22)20(2)15(19)23)21(10-18-13)7-6-17-9-11-4-3-5-16-8-11;8-6(9)5-2-1-3-7-4-5/h3-5,8,10,17H,6-7,9H2,1-2H3;1-4H,(H,8,9)InChIKey
DOWFKBHYDXGGML-UHFFFAOYSA-NSmiles
CN1C(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 470mg/kg (470mg/kg) | Pharmaceutica Acta Helvetiae. Vol. 48, Pg. 133, 1973. | |
mouse | LD50 | oral | 2530mg/kg (2530mg/kg) | Pharmaceutica Acta Helvetiae. Vol. 48, Pg. 133, 1973. | |
rat | LD50 | oral | 3700mg/kg (3700mg/kg) | Gazzetta Medica Italiana. Vol. 132, Pg. 36, 1973. | |
rat | LD50 | subcutaneous | 2300mg/kg (2300mg/kg) | Gazzetta Medica Italiana. Vol. 132, Pg. 36, 1973. |