Identification
CAS Number
1025967-78-5
Name
Lifitegrast
Synonyms
1025967-78-5 [RN]
9584
Lifitegrast [INN] [USAN]
Lifitegrast [Spanish] [INN]
Lifitégrast [French] [INN]
Lifitegrastum [Latin] [INN]
L-Phenylalanine, N-[[2-(6-benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)- [ACD/Index Name]
N-{[2-(1-Benzofuran-6-ylcarbonyl)-5,7-dichlor-1,2,3,4-tetrahydro-6-isochinolinyl]carbonyl}-3-(methylsulfonyl)-L-phenylalanin [German] [ACD/IUPAC Name]
N-{[2-(1-Benzofuran-6-ylcarbonyl)-5,7-dichloro-1,2,3,4-tétrahydro-6-isoquinoléinyl]carbonyl}-3-(méthylsulfonyl)-L-phénylalanine [French] [ACD/IUPAC Name]
N-{[2-(1-Benzofuran-6-ylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl}-3-(methylsulfonyl)-L-phenylalanine [ACD/IUPAC Name]
(2S)-2-[[[2-(6-benzofuranyl-oxomethyl)-5,7-dichloro-3,4-dihydro-1H-isoquinolin-6-yl]-oxomethyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid
(2S)-2-[[2-(1-benzofuran-6-carbonyl)-5,7-dichloro3,4-dihydro-1H-isoquinoline-6-carbonyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid
(2S)-2-[[2-(1-benzofuran-6-ylcarbonyl)-5,7-dichloro-3,4-dihydro-1H-isoquinolin-6-yl]carbonylamino]-3-(3-methylsulfonylphenyl)propanoic acid
(2S)-2-[[2-(benzofuran-6-carbonyl)-5,7-dichloro-3,4-dihydro-1H-isoquinoline-6-carbonyl]amino]-3-(3-mesylphenyl)propionic acid
(2S)-2-[[2-(benzofuran-6-carbonyl)-5,7-dichloro-3,4-dihydro-1H-isoquinoline-6-carbonyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid
(S)-2-(2-(Benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid
compound 1g [PMID : 24900456]
DS-20052
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:133023
Lifitegrast|SAR 1118
MFCD28502439
N-[[2-(6-benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-L-phenylalanine
N-[2-(1-benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carbonyl]-3-(methanesulfonyl)-L-phenylalanine
SAR 1118|SAR-1118|SAR-1118-023
SAR1118
SAR-1118
SAR-1118-023
Umbelliferone-3-carboxylic acid
Xiidra
Xiidra®
SMILES
CS(=O)(=O)c1cccc(c1)C[C@@H](C(=O)O)NC(=O)c2c(cc3c(c2Cl)CCN(C3)C(=O)c4ccc5ccoc5c4)Cl
StdInChI
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
StdInChIKey
JFOZKMSJYSPYLN-QHCPKHFHSA-N
Molecular Formula
C29H24Cl2N2O7S
Molecular Weight
615.48
MDL Number
MFCD28502439
Properties
Appearance
White powder
Safety Data
WGK Germany
3
Specifications and Other Information of Our Lifitegrast CAS 1025967-78-5
Identification Methods
HNMR, HPLC
Purity
98% min
Shelf Life
2 years
Storage
Under room temperature away from light
Known Application
Lifitegrast is a leukocyte functional antigen 1 antagonist used to treat dry eye. It can inhibit T cell adhesion to ICAM-1, and can also inhibit the secretion of inflammatory cytokines in human peripheral blood mononuclear cells.