Vitas-M small molecule compound
methyl (8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Catalog ID
STK593609
SMILES COC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)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 C22H28N6O5 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O5/c1-24-20-19(21(30)25(2)22(24)31)28(14-18(29)33-4)17(23-20)13-26-9-11-27(12-10-26)15-5-7-16(32-3)8-6-15/h5-8H,9-14H2,1-4H3InChIKey
OGELMIZWXMXCBT-UHFFFAOYSA-NSynonyms
851940-49-3851940493
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)OC)CC(=O)OC
InChI=1SC22H28N6O5c1242019(21(30)25(2)22(24)31)28(1418(29)334)17(2320)132691127(121026)155716(323)8615h58H914H214H3
methyl(8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetate
methyl2(8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetate
METHYL2(8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL26DIOXOPURIN7YL)ACETATE
METHYL2(8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL26DIOXO137TRIHYDROPURIN7YL)ACETATE
MFCD04466523
ZINC000057122051
ZINC57122051
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