Vitas-M small molecule compound
3,4-bis({[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]carbonyl}amino)benzoic acid
Catalog ID
STK299898
SMILES OC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)NC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C39H30N4O8 MW 682.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H30N4O8/c44-33(18-5-10-25(11-6-18)42-35(46)29-20-1-2-21(15-20)30(29)36(42)47)40-27-14-9-24(39(50)51)17-28(27)41-34(45)19-7-12-26(13-8-19)43-37(48)31-22-3-4-23(16-22)32(31)38(43)49/h1-14,17,20-23,29-32H,15-16H2,(H,40,44)(H,41,45)(H,50,51)InChIKey
CXRQGUKYOXPLBJ-UHFFFAOYSA-NSynonyms
34bis(((4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenyl)carbonyl)amino)benzoicacid
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=C(C=C(C=C5)C(=O)O)NC(=O)C6=CC=C(C=C6)N7C(=O)C8C9CC(C8C7=O)C=C9
InChI=1SC39H30N4O8c4433(1851025(11618)4235(46)29201221(1520)30(29)36(42)47)402714924(39(50)51)1728(27)4134(45)1971226(13819)4337(48)31223423(1622)32(31)38(43)49h1141720232932H1516H2(H4044)(H4145)(H5051)
MFCD01797704
ZINC000150440113
ZINC000245227338
Check stock
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Check stock on Vitas-MAvailable files
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