Vitas-M small molecule compound
N-(1-benzofuran-2-ylmethyl)-N,N,N',N',N'-pentaethylhexane-1,6-diaminium
Catalog ID
STL147232
SMILES CC[N+](Cc1cc2c(o1)cccc2)(CCCCCC[N+](CC)(CC)CC)CC
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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 C25H44N2O MW 388.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H44N2O/c1-6-26(7-2,8-3)19-15-11-12-16-20-27(9-4,10-5)22-24-21-23-17-13-14-18-25(23)28-24/h13-14,17-18,21H,6-12,15-16,19-20,22H2,1-5H3/q+2InChIKey
IHPHULZJXCQBAN-UHFFFAOYSA-NSynonyms
1BENZOFURAN2YLMETHYLDIETHYL(6(TRIETHYLAZANIUMYL)HEXYL)AZANIUM
CC(N+)(CC)(CC)CCCCCC(N+)(CC)(CC)CC1=CC2=CC=CC=C2O1
CC(N+)(Cc1cc2c(o1)cccc2)(CCCCCC(N+)(CC)(CC)CC)CC
CC(N+)(Cc1cc2c(o1)cccc2)(CCCCCC(N+)(CC)(CC)CC)CC(I)(I)
InChI=1SC25H44N2Oc1626(7283)19151112162027(94105)222421231713141825(23)2824h1314171821H6121516192022H215H3q+2
MFCD03297886
N(1benzofuran2ylmethyl)NNNNNpentaethylhexane16diaminium
N1(benzofuran2ylmethyl)N1N1N6N6N6pentaethylhexane16diaminiumiodide
ZINC000004908882
ZINC04908882
ZINC4908882
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