Vitas-M small molecule compound
8-{[4-amino-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]methoxy}-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK768520
SMILES Nc1nc(COc2nc3c(n2Cc2ccc(cc2)C)c(=O)n(c(=O)n3C)C)nc(n1)N1CCOCC1
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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 C23H27N9O4 MW 493.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N9O4/c1-14-4-6-15(7-5-14)12-32-17-18(29(2)23(34)30(3)19(17)33)27-22(32)36-13-16-25-20(24)28-21(26-16)31-8-10-35-11-9-31/h4-7H,8-13H2,1-3H3,(H2,24,25,26,28)InChIKey
IFMCHYUDLRXNAO-UHFFFAOYSA-NSynonyms
8((4amino6(morpholin4yl)135triazin2yl)methoxy)13dimethyl7(4methylbenzyl)37dihydro1Hpurine26dione
8((4AMINO6MORPHOLIN4YL(135TRIAZIN2YL))METHOXY)13DIMETHYL7((4METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8((4AMINO6MORPHOLIN4YL135TRIAZIN2YL)METHOXY)13DIMETHYL7((4METHYLPHENYL)METHYL)PURINE26DIONE
CC1=CC=C(C=C1)CN2C3=C(N=C2OCC4=NC(=NC(=N4)N)N5CCOCC5)N(C(=O)N(C3=O)C)C
InChI=1SC23H27N9O4c1144615(7514)12321718(29(2)23(34)30(3)19(17)33)2722(32)3613162520(24)2821(2616)318103511931h47H813H213H3(H224252628)
MFCD03308647
ZINC000001088003
ZINC01088003
ZINC1088003
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