Vitas-M small molecule compound
6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-(piperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK586651
SMILES OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCNCC1)COc1ccc(cc1)C
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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 C20H26N6O4 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N6O4/c1-13-3-5-15(6-4-13)30-12-14(27)11-26-16-17(24(2)20(29)23-18(16)28)22-19(26)25-9-7-21-8-10-25/h3-6,14,21,27H,7-12H2,1-2H3,(H,23,28,29)InChIKey
UIJZHVBEQKOAJS-UHFFFAOYSA-NSynonyms
850731-79-26hydroxy7(2hydroxy3(4methylphenoxy)propyl)3methyl8(piperazin1yl)37dihydro2Hpurin2one
7(2HYDROXY3(4METHYLPHENOXY)PROPYL)3METHYL8PIPERAZIN1YLPURINE26DIONE
850731792
CC1=CC=C(C=C1)OCC(CN2C3=C(N=C2N4CCNCC4)N(C(=O)NC3=O)C)O
InChI=1SC20H26N6O4c1133515(6413)301214(27)11261617(24(2)20(29)2318(16)28)2219(26)25972181025h36142127H712H212H3(H232829)
MFCD07198883
ZINC000013810688
ZINC000013810689
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