Vitas-M small molecule compound
methyl {4-[7-(4-fluorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetate
Catalog ID
STK573397
SMILES COC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(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 C20H23FN6O4 MW 430.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN6O4/c1-24-17-16(18(29)23-20(24)30)27(11-13-3-5-14(21)6-4-13)19(22-17)26-9-7-25(8-10-26)12-15(28)31-2/h3-6H,7-12H2,1-2H3,(H,23,29,30)InChIKey
OSXMOCYXJJIOJR-UHFFFAOYSA-NSynonyms
895819-73-5CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CC(=O)OC)CC4=CC=C(C=C4)F
InChI=1SC20H23FN6O4c1241716(18(29)2320(24)30)27(11133514(21)6413)19(2217)269725(81026)1215(28)312h36H712H212H3(H232930)
methyl(4(7(4fluorobenzyl)6hydroxy3methyl2oxo37dihydro2Hpurin8yl)piperazin1yl)acetate
METHYL2(4(7((4FLUOROPHENYL)METHYL)3METHYL26DIOXO137TRIHYDROPURIN8YL)PIPERAZINYL)ACETATE
METHYL2(4(7((4FLUOROPHENYL)METHYL)3METHYL26DIOXOPURIN8YL)PIPERAZIN1YL)ACETATE
MFCD08731991
ZINC000035877383
ZINC35877383
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