Apremilast-d5 | CAS No. 1258597-47-5

Apremilast-d5

Basic Information

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CAS Number

1258597-47-5

Molecular Formula

C22H19D5N2O7S

Molecular Weight

465.54 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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COc1ccc(cc1OC(C([2H])([2H])[2H])([2H])[2H])[C@H](N1C(=O)c2c(C1=O)c(ccc2)NC(=O)C)CS(=O)(=O)C

InChI

InChI=1S/C22H24N2O7S/c1-5-31-19-11-14(9-10-18(19)30-3)17(12-32(4,28)29)24-21(26)15-7-6-8-16(23-13(2)25)20(15)22(24)27/h6-11,17H,5,12H2,1-4H3,(H,23,25)/t17-/m1/s1/i1D3,5D2

InChIKey

IMOZEMNVLZVGJZ-JVFKXMKASA-N

LogP

2.4342000000000006

Topological Polar Surface Area

119.07999999999998 Å²

Hydrogen Bond Donor/Acceptor

1 / 9

Synonyms & References

English

Apremilast-d5
(S)-N-(2-(2-(methylsulfonyl)-1-(3-(ethoxy-d5)-4-(methoxy)phenyl)ethyl)-1,3-dioxoisoindolin-4-yl)acetamide
Apremilast D5 (racemic)
Apremilast D5
Apremilast-d
(S)-N-(2-(1-(3-(Ethoxy-d5)-4-methoxyphenyl)-2-(methylsulfonyl)ethyl)-1,3-dioxoisoindolin-4-yl)acetamide

MDL Number

MFCD30747911

FAQ

What is Apremilast-d5 (CAS: 1258597-47-5)?

Apremilast-d5 is a stable, deuterium-labeled analog of apremilast, a phosphodiesterase 4 (PDE4) inhibitor used for treating psoriasis and rheumatoid arthritis. It has the same chemical formula as apremilast (C21H26N6O4), but with a deuterium atom replacing a hydrogen atom at position 7.

What are the main uses of Apremilast-d5 (CAS: 1258597-47-5)?

Apremilast-d5 is primarily used in research and development as a labeled version of apremilast. It helps in studying the pharmacokinetics, metabolism, and distribution of the parent compound in biological systems.

Is Apremilast-d5 (CAS: 1258597-47-5) safe?

Apremilast-d5 is considered safe when handled with appropriate precautions. However, like other chemical substances, it should be stored away from direct sunlight, and appropriate personal protective equipment (PPE) such as gloves and safety glasses should be worn during handling.

How should Apremilast-d5 (CAS: 1258597-47-5) be stored?

Apremilast-d5 should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. Ideal storage conditions are at a temperature range of 2-8°C (36-46°F) to ensure stability and safety.