Vitas-M small molecule compound
8-[(2E)-2-(2-chloro-6-fluorobenzylidene)hydrazinyl]-6-hydroxy-3-methyl-7-octyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STL044566
SMILES CCCCCCCCn1c(N/N=C/c2c(F)cccc2Cl)nc2c1c(O)nc(=O)n2C
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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 C21H26ClFN6O2 MW 448.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClFN6O2/c1-3-4-5-6-7-8-12-29-17-18(28(2)21(31)26-19(17)30)25-20(29)27-24-13-14-15(22)10-9-11-16(14)23/h9-11,13H,3-8,12H2,1-2H3,(H,25,27)(H,26,30,31)/b24-13+InChIKey
ZHNLIAIAPDJDNJ-ZMOGYAJESA-NSynonyms
CCCCCCCCn1c(NN=Cc2c(F)cccc2Cl)nc2c1c(O)nc(=O)n2C
MFCD03795859
ZINC000097969441
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