Vitas-M small molecule compound
8-[benzyl(2-hydroxyethyl)amino]-7-(2-chlorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK841792
SMILES OCCN(c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)Cc1ccccc1
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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 C22H22ClN5O3 MW 439.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O3/c1-26-19-18(20(30)25-22(26)31)28(14-16-9-5-6-10-17(16)23)21(24-19)27(11-12-29)13-15-7-3-2-4-8-15/h2-10,29H,11-14H2,1H3,(H,25,30,31)InChIKey
DGIBAOPEFYCOGN-UHFFFAOYSA-NSynonyms
442864-93-9442864939
8(BENZYL(2HYDROXYETHYL)AMINO)7((2CHLOROPHENYL)METHYL)3METHYLPURINE26DIONE
8(BENZYL(2HYDROXYETHYL)AMINO)7(2CHLOROBENZYL)3METHYL1HPURINE26(3H7H)DIONE
8(benzyl(2hydroxyethyl)amino)7(2chlorobenzyl)3methyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)N(CCO)CC3=CC=CC=C3)CC4=CC=CC=C4Cl
InChI=1SC22H22ClN5O3c1261918(20(30)2522(26)31)28(14169561017(16)23)21(2419)27(111229)13157324815h21029H1114H21H3(H253031)
MFCD03289272
OCCN(c1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C)Cc1ccccc1
ZINC000000634509
ZINC00634509
ZINC634509
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