Structure

Elinogrel

CAS
936500-94-6
Catalog Number
ACM936500946-1
Category
Inhibitors
Molecular Weight
523.94
Molecular Formula
C20H15ClFN5O5S2

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Specification

Description
Elinogrel, also known as PRT 060128, is P2Y12 inhibitor. Similarly to ticagrelor and in contrast to clopidogrel, elinogrel was a reversible inhibitor that acted fast and short (for about 12 hours), and it was not a prodrug but pharmacologically active itself. The substance was used in form of its potassium salt, intravenously for acute treatment and orally for long-term treatment. Development was terminated in 2012.
Synonyms
PRT 060128; PRT-060128; PRT060128; Elinogrel
IUPAC Name
5-chloro-N-((4-(6-fluoro-7-(methylamino)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)phenyl)carbamoyl)thiophene-2-sulfonamide
Canonical SMILES
O=C(NC1=CC=C(N2C(NC3=C(C=C(F)C(NC)=C3)C2=O)=O)C=C1)NS(=O)(C4=CC=C(Cl)S4)=O
InChI
InChI=1S/C20H15ClFN5O5S2/c1-23-15-9-14-12(8-13(15)22)18(28)27(20(30)25-14)11-4-2-10(3-5-11)24-19(29)26-34(31,32)17-7-6-16(21)33-17/h2-9,23H,1H3,(H,25,30)(H2,24,26,29)
InChI Key
LGSDFTPAICUONK-UHFFFAOYSA-N
Solubility
Soluble in DMSO, not in water
Appearance
Solid powder
Shelf Life
>2 years if stored properly
Storage
Dry, dark and at 0-4 °C for short term (days to weeks) or -20 °C for long term (months to years).
Alternative CAS
936501-01-8 (potassium); 936500-94-6 (free base)
Drug Formulation
This drug may be formulated in DMSO
Elemental Analysis
C, 45.85; H, 2.89; Cl, 6.77; F, 3.63; N, 13.37; O, 15.27; S, 12.24
Exact Mass
523.0187
HS Tariff Code
2934.99.9001
Shipping
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Stock Solution Storage
0-4 °C for short term (days to weeks), or -20 °C for long term (months).
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