Vitas-M small molecule compound

2,2'-[(benzylimino)dimethanediyl]bishexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK268939
SMILES O=C1N(CN(CN2C(=O)C3C(C2=O)C2CC3CC2)Cc2ccccc2)C(=O)C2C1C1CCC2C1

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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 C27H31N3O4 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4/c31-24-20-16-6-7-17(10-16)21(20)25(32)29(24)13-28(12-15-4-2-1-3-5-15)14-30-26(33)22-18-8-9-19(11-18)23(22)27(30)34/h1-5,16-23H,6-14H2
InChIKey
LVLGVQQQVNFGMK-UHFFFAOYSA-N
Synonyms

22((benzylimino)dimethanediyl)bishexahydro1H47methanoisoindole13(2H)dione
C1CC2CC1C3C2C(=O)N(C3=O)CN(CC4=CC=CC=C4)CN5C(=O)C6C7CCC(C7)C6C5=O
InChI=1SC27H31N3O4c312420166717(1016)21(20)25(32)29(24)1328(12154213515)143026(33)22188919(1118)23(22)27(30)34h151623H614H2
MFCD01465964
ZINC000239339204
ZINC000239339207

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.