Vitas-M small molecule compound
3-(2-methoxyphenyl)-7-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL127905
SMILES COc1ccccc1n1c(=O)[nH]c2c(c1=O)cnc(n2)N1CCN(CC1)c1ncccn1
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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 C21H20N8O3 MW 432.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O3/c1-32-16-6-3-2-5-15(16)29-18(30)14-13-24-20(25-17(14)26-21(29)31)28-11-9-27(10-12-28)19-22-7-4-8-23-19/h2-8,13H,9-12H2,1H3,(H,24,25,26,31)InChIKey
ZPMOUOBXAZGJCD-UHFFFAOYSA-NSynonyms
3(2methoxyphenyl)7(4(pyrimidin2yl)piperazin1yl)pyrimido(45d)pyrimidine24(1H3H)dione
6(2methoxyphenyl)2(4pyrimidin2ylpiperazin1yl)8Hpyrimido(45d)pyrimidine57dione
COC1=CC=CC=C1N2C(=O)C3=CN=C(N=C3NC2=O)N4CCN(CC4)C5=NC=CC=N5
COc1ccccc1n1c(=O)(nH)c2c(c1=O)cnc(n2)N1CCN(CC1)c1ncccn1
InChI=1SC21H20N8O3c13216632515(16)2918(30)14132420(2517(14)2621(29)31)2811927(101228)19227482319h2813H912H21H3(H24252631)
MFCD20740839
ZINC000067264321
ZINC67264321
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