Vitas-M small molecule compound
{8-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetic acid
Catalog ID
STK937270
SMILES OC(=O)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1F
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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 C19H21FN6O4 MW 416.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21FN6O4/c1-22-16-15(17(29)23(2)19(22)30)26(11-14(27)28)18(21-16)25-9-7-24(8-10-25)13-6-4-3-5-12(13)20/h3-6H,7-11H2,1-2H3,(H,27,28)InChIKey
FXYKQCAVIZADMS-UHFFFAOYSA-NSynonyms
946328-98-9(8(4(2fluorophenyl)piperazin1yl)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)aceticacid
2(8(4(2FLUOROPHENYL)PIPERAZIN1YL)13DIMETHYL26DIOXO23DIHYDRO1HPURIN7(6H)YL)ACETICACID
2(8(4(2fluorophenyl)piperazin1yl)13dimethyl26dioxopurin7yl)aceticacid
2(8(4(2FLUOROPHENYL)PIPERAZINYL)13DIMETHYL26DIOXO137TRIHYDROPURIN7YL)ACETICACID
946328989
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C4=CC=CC=C4F)CC(=O)O
InChI=1SC19H21FN6O4c1221615(17(29)23(2)19(22)30)26(1114(27)28)18(2116)259724(81025)13643512(13)20h36H711H212H3(H2728)
MFCD09986872
ZINC000012443311
ZINC12443311
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