Vitas-M small molecule compound

1-ethyl-7-methyl-3-{[4-(7H-purin-6-yl)piperazin-1-yl]carbonyl}-1,8-naphthyridin-4(1H)-one

Catalog ID
STK636360
SMILES CCn1cc(C(=O)N2CCN(CC2)c2ncnc3c2[nH]cn3)c(=O)c2c1nc(C)cc2

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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 C21H22N8O2 MW 418.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N8O2/c1-3-27-10-15(17(30)14-5-4-13(2)26-19(14)27)21(31)29-8-6-28(7-9-29)20-16-18(23-11-22-16)24-12-25-20/h4-5,10-12H,3,6-9H2,1-2H3,(H,22,23,24,25)
InChIKey
IEFKTMPWFNEVGZ-UHFFFAOYSA-N
Synonyms
1010921-20-6
1010921206
1ethyl7methyl3((4(7Hpurin6yl)piperazin1yl)carbonyl)18naphthyridin4(1H)one
1ethyl7methyl3(4(7Hpurin6yl)piperazine1carbonyl)18naphthyridin4one
3(4(9Hpurin6yl)piperazine1carbonyl)1ethyl7methyl18naphthyridin4(1H)one
CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5
CCn1cc(C(=O)N2CCN(CC2)c2ncnc3c2(nH)cn3)c(=O)c2c1nc(C)cc2
CCn1cc(C(=O)N2CCN(CC2)c2ncnc3c2nc(nH)3)c(=O)c2c1nc(C)cc2
InChI=1SC21H22N8O2c13271015(17(30)145413(2)2619(14)27)21(31)298628(7929)201618(23112216)24122520h451012H369H212H3(H22232425)
MFCD18161044
ZINC000012323839
ZINC12323839

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Available files

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