5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate

Basic Information

View in Editor

CAS Number

150322-43-3

Molecular Formula

C20H20FNO3S

Molecular Weight

373.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Powder

Melting Point

120.0 to 124.0 deg-C

Boiling Point

493.486°C at 760 mmHg

Solubility

DMSO: >5mg/mL (warmed at 60 °C)

SMILES

View in Editor

CC(=O)OC1=CC2=C(S1)CCN(C2)C(C3=CC=CC=C3F)C(=O)C4CC4

InChI

InChI=1S/C20H20FNO3S/c1-12(23)25-18-10-14-11-22(9-8-17(14)26-18)19(20(24)13-6-7-13)15-4-2-3-5-16(15)21/h2-5,10,13,19H,6-9,11H2,1H3

InChIKey

DTGLZDAWLRGWQN-UHFFFAOYSA-N

LogP

3.8910000000000036

Topological Polar Surface Area

46.61 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

555

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 9 Class 9

Synonyms & References

English

KS-5301
2-Acetoxy-5-(alpha-cyclopropylcarbonyl-2-fluorobenzyl)-4,5,6,7-tetrahydrothieno[3,2-c] pyridine
CHEBI:87723
SW219175-1
DB06209
Efient
Ethanone, 2-(2-(acetyloxy)-6,7-dihydrothieno(3,2-c)pyridin-5(4H)-yl)-1-cyclopropyl-2-(2-fluorophenyl)-
SCHEMBL14112007
CCG-268338
LY640315
AM20090728
5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-2-yl acetate
PRASUGREL [EMA EPAR]
FT-0650150
BDBM50589231
FD7194
BCP01882
SB20805
SCHEMBL245032
CHEBI:87715
NSC 759625
CS-747
NCGC00188690-01
Prasugrel
MLS006012001
AB01274761-01
[5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-6,7-dihydro-4H-thieno[4,5-c]pyridin-2-yl] acetate
Prasugrel, >=98% (HPLC)
HMS3654D09
Pcr 4099
HMS3604B09

MDL Number

MFCD09954140

FAQ

What is 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3)?

5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3) is a synthetic organic compound with a complex structure. It contains a thieno[3,2-c]pyridine ring system and an acetic acid group. This compound is known for its potential applications in medicinal chemistry and is typically used in research settings. Its molecular formula is C21H21FN2O3, and it exhibits solubility in organic solvents.

What are the main uses of 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3)?

This compound is primarily used in pharmaceutical research for the development of potential therapeutic agents. It may serve as a lead compound in drug discovery, particularly in the context of neurological and anti-inflammatory treatments. Additionally, it is used in chemical synthesis and as a building block for more complex molecules. Its use in industrial and food applications is limited due to its specialized nature.

Is 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3) safe?

The safety of 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3) depends on its handling and exposure conditions. As a chemical compound, it should be treated with care, and appropriate safety measures such as gloves, goggles, and ventilation are recommended. While specific toxicity data may vary, it is generally considered safe in controlled research environments when handled properly.

How should 5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3) be stored?

5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CAS: 150322-43-3) should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container at a temperature below 25°C and away from moisture and direct light. Proper storage helps prevent degradation and ensures the compound remains suitable for use in laboratory and pharmaceutical applications.