Lifitegrast

CAS

1025967-78-5

Catalog Number

ACM1025967785

Category

Other Products

Molecular Weight

Molecular Formula

C₂₉H₂₄Cl₂N₂O₇S

MSDS COA Spec Sheet

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Specification

Synonyms

lifitegrast;Lifitegrast, SAR 1118;L-Phenylalanine,N-[[2-(6-benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-;N-[[2-(6-Benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-L-phenylalanine;SAR 1118;(S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid;(S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic;liftegrast

What is the molecular formula of lifitegrast as per the reference?

The molecular formula of lifitegrast is C29H24Cl2N2O7S.

What is the molecular weight of lifitegrast?

The molecular weight of lifitegrast is 615.5 g/mol.

What is the IUPAC name of lifitegrast?

The IUPAC name of lifitegrast is (2S)-2-[[2-(1-benzofuran-6-carbonyl)-5,7-dichloro-3,4-dihydro-1H-isoquinoline-6-carbonyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid.

What is the InChI of lifitegrast?

The InChI of lifitegrast is InChI=1S/C29H24Cl2N2O7S/c1-41(38,39)20-4-2-3-16(11-20)12-23(29(36)37)32-27(34)25-22(30)13-19-15-33(9-7-21(19)26(25)31)28(35)18-6-5-17-8-10-40-24(17)14-18/h2-6,8,10-11,13-14,23H,7,9,12,15H2,1H3,(H,32,34)(H,36,37)/t23-/m0/s1.

What is the InChIKey of lifitegrast?

The InChIKey of lifitegrast is JFOZKMSJYSPYLN-QHCPKHFHSA-N.

What is the canonical SMILES of lifitegrast?

The canonical SMILES of lifitegrast is CS(=O)(=O)C1=CC=CC(=C1)CC(C(=O)O)NC(=O)C2=C(C=C3CN(CCC3=C2Cl)C(=O)C4=CC5=C(C=C4)C=CO5)Cl.

What is the drug type of lifitegrast?

Lifitegrast is a Lymphocyte Function-Associated Antigen-1 Antagonist.

When was lifitegrast approved by the FDA?

Lifitegrast was approved by the FDA in July 2016 under the trade name Xiidra for the treatment of keratoconjunctivitis sicca (dry eye syndrome).

What is the role of lifitegrast as per the description in the reference?

Lifitegrast has a role as an anti-inflammatory drug and a lymphocyte function-associated antigen-1 antagonist.

What is the KEGG ID of lifitegrast?

The KEGG ID of lifitegrast is D10374.