Structure of Lifitegrast CAS 1025967 78 5 - Lifitegrast CAS 1025967-78-5

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/​c​h​e​b​i​/​s​e​a​r​c​h​I​d​.​d​o​?​c​h​e​b​i​I​d​=​C​H​E​B​I​:​1​3​3​023
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.

This prod­uct is devel­oped by our R&D com­pa­ny Cam­ing Phar­ma­ceu­ti­cal Ltd(http://​www​.cam​ing​.com/), and here is the cor­re­spond­ing link http://​www​.cam​ing​.com/​l​i​f​i​t​e​g​r​a​s​t​-​c​a​s​-​1​0​2​5​9​6​7​-​7​8​-5/

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