Vitas-M small molecule compound
[1-(2-chloro-7H-purin-6-yl)piperidin-4-yl][4-(3-methoxyphenyl)piperazin-1-yl]methanone
Catalog ID
STK626325
SMILES COc1cccc(c1)N1CCN(CC1)C(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2
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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 C22H26ClN7O2 MW 455.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN7O2/c1-32-17-4-2-3-16(13-17)28-9-11-30(12-10-28)21(31)15-5-7-29(8-6-15)20-18-19(25-14-24-18)26-22(23)27-20/h2-4,13-15H,5-12H2,1H3,(H,24,25,26,27)InChIKey
VXSOGJRVKURLRA-UHFFFAOYSA-NSynonyms
929868-84-8(1(2chloro7Hpurin6yl)piperidin4yl)(4(3methoxyphenyl)piperazin1yl)methanone
(1(2chloro9Hpurin6yl)piperidin4yl)(4(3methoxyphenyl)piperazin1yl)methanone
929868848
COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCN(CC3)C4=NC(=NC5=C4NC=N5)Cl
COc1cccc(c1)N1CCN(CC1)C(=O)C1CCN(CC1)c1nc(Cl)nc2c1(nH)cn2
COc1cccc(c1)N1CCN(CC1)C(=O)C1CCN(CC1)c1nc(Cl)nc2c1nc(nH)2
InChI=1SC22H26ClN7O2c1321742316(1317)2891130(121028)21(31)155729(8615)201819(25142418)2622(23)2720h241315H512H21H3(H24252627)
MFCD09798579
ZINC000008990660
ZINC08990660
ZINC8990660
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