Vitas-M small molecule compound

N-[4-(biphenyl-4-yloxy)phenyl]-2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetamide

Catalog ID
STK264530
SMILES O=C(CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Nc1ccc(cc1)Oc1ccc(cc1)c1ccccc1

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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 C31H26N2O4 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O4/c34-27(17-33-30(35)28-23-14-15-24(26-16-25(23)26)29(28)31(33)36)32-20-8-12-22(13-9-20)37-21-10-6-19(7-11-21)18-4-2-1-3-5-18/h1-15,23-26,28-29H,16-17H2,(H,32,34)
InChIKey
HKHQXBVGOCUPMG-UHFFFAOYSA-N
Synonyms

C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)NC5=CC=C(C=C5)OC6=CC=C(C=C6)C7=CC=CC=C7
InChI=1SC31H26N2O4c3427(173330(35)2823141524(261625(23)26)29(28)31(33)36)322081222(13920)372110619(71121)184213518h11523262829H1617H2(H3234)
MFCD06003073
N(4(biphenyl4yloxy)phenyl)2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetamide
ZINC000239090914
ZINC000239090917

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Available files

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