Vitas-M small molecule compound

5-{[3-(ethoxycarbonyl)piperidin-1-yl]methyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid

Catalog ID
STK685245
SMILES CCOC(=O)C1CCCN(C1)Cc1c(=O)[nH]c(=O)[nH]c1C(=O)O

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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 C14H19N3O6 MW 325.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3O6/c1-2-23-13(21)8-4-3-5-17(6-8)7-9-10(12(19)20)15-14(22)16-11(9)18/h8H,2-7H2,1H3,(H,19,20)(H2,15,16,18,22)
InChIKey
ZCNZINOPHUPBCY-UHFFFAOYSA-N
Synonyms

5((3(ethoxycarbonyl)piperidin1yl)methyl)26dioxo1236tetrahydropyrimidine4carboxylicacid
5((3ETHOXYCARBONYLPIPERIDIN1YL)METHYL)24DIOXO1HPYRIMIDINE6CARBOXYLICACID
CCOC(=O)C1CCCN(C1)Cc1c(=O)(nH)c(=O)(nH)c1C(=O)O
CCOC(=O)C1CCCN(C1)CC2=C(NC(=O)NC2=O)C(=O)O
InChI=1SC14H19N3O6c122313(21)843517(68)7910(12(19)20)1514(22)1611(9)18h8H27H21H3(H1920)(H215161822)
MFCD05857980
ZINC000001428798
ZINC000001428799

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Available files

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