Indomethacin-d4

Basic Information

View in Editor

CAS Number

87377-08-0

Molecular Formula

C19H12ClD4NO4

Molecular Weight

361.82 g/mol

Basic Physical Properties

Melting Point

151-153°C

SMILES

View in Editor

COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1c([2H])c([2H])c(c(c1[2H])[2H])Cl)C

InChI

InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)/i3D,4D,5D,6D

InChIKey

CGIGDMFJXJATDK-LNFUJOGGSA-N

LogP

3.9273200000000017

Topological Polar Surface Area

68.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Synonyms & References

English

Indomethacin-d4?(chlorobenzoyl-d4)
Indomethacin-d4
1-(-p-chlorobenzoyl)-2-methyl-5-methoxy-3-indolylacetic acid-d4
2-(1-(4-chlorobenzoyl-2,3,5,6-d4-2,3,5,6-d4)-5-methoxy-2-methyl-1H-indol-3-yl)acetic acid

MDL Number

MFCD06658917

FAQ

What is Indomethacin-d4 (CAS: 87377-08-0)?

Indomethacin-d4 (CAS: 87377-08-0) is a stable, deuterated derivative of indomethacin, a non-steroidal anti-inflammatory drug (NSAID). It is used primarily for structural studies and metabolic research due to its unique deuterium isotope labeling.

What are the main uses of Indomethacin-d4 (CAS: 87377-08-0)?

The main uses of Indomethacin-d4 (CAS: 87377-08-0) include structural elucidation, metabolic and pharmacokinetic studies, and as a reference compound in medicinal chemistry research. It is particularly useful for studying the metabolism of NSAIDs in vivo.

Is Indomethacin-d4 (CAS: 87377-08-0) safe?

Indomethacin-d4 (CAS: 87377-08-0) is generally considered safe for research purposes, but like any NSAID, it should be handled with caution. Users should follow standard safety protocols, including wearing personal protective equipment and using appropriate ventilation.

How should Indomethacin-d4 (CAS: 87377-08-0) be stored?

Indomethacin-d4 (CAS: 87377-08-0) should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent degradation. Optimal storage conditions are between 2-8°C to maintain its stability and purity.