Vitas-M small molecule compound
8-{[2-(diethylamino)ethyl]amino}-7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK540133
SMILES CCN(CCNc1nc2c(n1CC(COc1ccc(cc1)[N+](=O)[O-])O)c(=O)[nH]c(=O)n2C)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 C21H29N7O6 MW 475.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N7O6/c1-4-26(5-2)11-10-22-20-23-18-17(19(30)24-21(31)25(18)3)27(20)12-15(29)13-34-16-8-6-14(7-9-16)28(32)33/h6-9,15,29H,4-5,10-13H2,1-3H3,(H,22,23)(H,24,30,31)InChIKey
BOYJURIVTWLJIU-UHFFFAOYSA-NSynonyms
377048-70-9377048709
8((2(DIETHYLAMINO)ETHYL)AMINO)7(2HYDROXY3(4NITROPHENOXY)PROPYL)3METHYL1HPURINE26(3H7H)DIONE
8((2(diethylamino)ethyl)amino)7(2hydroxy3(4nitrophenoxy)propyl)3methyl37dihydro1Hpurine26dione
8(2(diethylamino)ethylamino)7(2hydroxy3(4nitrophenoxy)propyl)3methylpurine26dione
8(2DIETHYLAMINOETHYLAMINO)7(2HYDROXY3(4NITROPHENOXY)PROPYL)3METHYLPURINE26DIONE
CCN(CC)CCNC1=NC2=C(N1CC(COC3=CC=C(C=C3)(N+)(=O)(O))O)C(=O)NC(=O)N2C
CCN(CCNc1nc2c(n1CC(COc1ccc(cc1)(N+)(=O)(O))O)c(=O)(nH)c(=O)n2C)CC
InChI=1SC21H29N7O6c1426(52)11102220231817(19(30)2421(31)25(18)3)27(20)1215(29)1334168614(7916)28(32)33h691529H451013H213H3(H2223)(H243031)
MFCD02982459
ZINC000001832208
ZINC000001832209
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.