Vitas-M small molecule compound

methyl 1-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]piperidine-4-carboxylate

Catalog ID
STK069877
SMILES COC(=O)C1CCN(CC1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

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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 C16H21N5O5 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O5/c1-18-13-12(14(23)19(2)16(18)25)21(9-17-13)8-11(22)20-6-4-10(5-7-20)15(24)26-3/h9-10H,4-8H2,1-3H3
InChIKey
QXHFXMLCKREZSJ-UHFFFAOYSA-N
Synonyms
349441-34-5
349441345
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CCC(CC3)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C
InChI=1SC16H21N5O5c1181312(14(23)19(2)16(18)25)21(91713)811(22)206410(5720)15(24)263h910H48H213H3
methyl1((13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetyl)piperidine4carboxylate
METHYL1(2(13DIMETHYL26DIOXO137TRIHYDROPURIN7YL)ACETYL)PIPERIDINE4CARBOXYLATE
methyl1(2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetyl)piperidine4carboxylate
methyl1(2(13dimethyl26dioxopurin7yl)acetyl)piperidine4carboxylate
MFCD02862332
STK069877
ZINC000000892816
ZINC00892816
ZINC892816

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.