Vitas-M small molecule compound

1-methyl-3-{[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]carbonyl}-1H-pyrazole-4-carboxylic acid

Catalog ID
STL392842
SMILES O=C(N1CCN(CC1)C(=O)c1nn(cc1C(=O)O)C)C1CCCO1

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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 C15H20N4O5 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N4O5/c1-17-9-10(15(22)23)12(16-17)14(21)19-6-4-18(5-7-19)13(20)11-3-2-8-24-11/h9,11H,2-8H2,1H3,(H,22,23)
InChIKey
OIUMYGQPXFTEDG-UHFFFAOYSA-N
Synonyms
1174835-00-7
1174835007
1METHYL3((4(TETRAHYDROFURAN2YLCARBONYL)PIPERAZIN1YL)CARBONYL)1HPYRAZOLE4CARBOXYLICACID
1methyl3(4(oxolane2carbonyl)piperazine1carbonyl)pyrazole4carboxylicacid
CN1C=C(C(=N1)C(=O)N2CCN(CC2)C(=O)C3CCCO3)C(=O)O
InChI=1SC15H20N4O5c117910(15(22)23)12(1617)14(21)196418(5719)13(20)113282411h911H28H21H3(H2223)
MFCD09470355
ZINC000020614927
ZINC000020614928

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Available files

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