Vitas-M small molecule compound
5,6-bis(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitrophenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Catalog ID
STK264414
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1(C(=O)C2(c2ccccc2)C(=C1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2)c1ccccc1
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C42H28N2O9 MW 704.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H28N2O9/c1-23-12-15-28(29(18-23)44(48)49)43-38(45)36-37(39(43)46)42(27-10-6-3-7-11-27)35(25-14-17-31-33(20-25)53-22-51-31)34(24-13-16-30-32(19-24)52-21-50-30)41(36,40(42)47)26-8-4-2-5-9-26/h2-20,36-37H,21-22H2,1H3InChIKey
UOKUXUQBZANHET-UHFFFAOYSA-NSynonyms
56bis(13benzodioxol5yl)2(4methyl2nitrophenyl)47diphenyl3a477atetrahydro1H47methanoisoindole138(2H)trione
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C4(C(=C(C3(C4=O)C5=CC=CC=C5)C6=CC7=C(C=C6)OCO7)C8=CC9=C(C=C8)OCO9)C1=CC=CC=C1)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1(C(=O)C2(c2ccccc2)C(=C1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2)c1ccccc1
InChI=1SC42H28N2O9c123121528(29(1823)44(48)49)4338(45)3637(39(43)46)42(27106371127)35(2514173133(2025)53225131)34(2413163032(1924)52215030)41(3640(42)47)268425926h2203637H2122H21H3
MFCD02623595
ZINC000150367018
ZINC000150367023
Check stock
See real-time availability and sample size for STK264414 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.