Vitas-M small molecule compound

2,7-bis[(dipropylamino)methyl]-1,8-bis(4-methoxyphenyl)octane-1,8-dione

Catalog ID
STK531838
SMILES CCCN(CC(C(=O)c1ccc(cc1)OC)CCCCC(C(=O)c1ccc(cc1)OC)CN(CCC)CCC)CCC

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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 C36H56N2O4 MW 580.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H56N2O4/c1-7-23-37(24-8-2)27-31(35(39)29-15-19-33(41-5)20-16-29)13-11-12-14-32(28-38(25-9-3)26-10-4)36(40)30-17-21-34(42-6)22-18-30/h15-22,31-32H,7-14,23-28H2,1-6H3
InChIKey
KYYHSOSBCCXAAE-UHFFFAOYSA-N
Synonyms

27bis((dipropylamino)methyl)18bis(4methoxyphenyl)octane18dione
CCCN(CCC)CC(CCCCC(CN(CCC)CCC)C(=O)C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)OC
InChI=1SC36H56N2O4c172337(2482)2731(35(39)29151933(415)201629)1311121432(2838(2593)26104)36(40)30172134(426)221830h15223132H7142328H216H3
MFCD00699223
ZINC000102410227
ZINC000102410232

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Available files

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