Vitas-M small molecule compound

2-[(E)-{2-[4,6-di(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-4-iodophenol

Catalog ID
STL505579
SMILES Oc1ccc(cc1/C=N/Nc1nc(nc(n1)N1CCCCCC1)N1CCCCCC1)I

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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 C22H30IN7O MW 535.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30IN7O/c23-18-9-10-19(31)17(15-18)16-24-28-20-25-21(29-11-5-1-2-6-12-29)27-22(26-20)30-13-7-3-4-8-14-30/h9-10,15-16,31H,1-8,11-14H2,(H,25,26,27,28)/b24-16+
InChIKey
GSCYNLDPEIKHIP-LFVJCYFKSA-N
Synonyms

135637773
2((~(E))((46bis(azepan1yl)135triazin2yl)hydrazinylidene)methyl)4iodophenol
2((E)(2(46di(azepan1yl)135triazin2yl)hydrazinylidene)methyl)4iodophenol
InChI=1SC22H30IN7Oc231891019(31)17(1518)162428202521(291151261229)2722(2620)301373481430h910151631H181114H2(H25262728)b2416+
MFCD00332501
ZINC000828917444

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Available files

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