Vitas-M small molecule compound

1'-(2-methoxyethyl)-3',5'-dimethyl-1'H,2H-3,4'-bipyrazole-5-carboxylic acid

Catalog ID
STL425235
SMILES COCCn1nc(c(c1C)c1[nH]nc(c1)C(=O)O)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 C12H16N4O3 MW 264.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O3/c1-7-11(8(2)16(15-7)4-5-19-3)9-6-10(12(17)18)14-13-9/h6H,4-5H2,1-3H3,(H,13,14)(H,17,18)
InChIKey
HJFKUTMLDPZPOU-UHFFFAOYSA-N
Synonyms

1(2methoxyethyl)35dimethyl1H1H(34bipyrazole)5carboxylicacid
1(2methoxyethyl)35dimethyl1H2H34bipyrazole5carboxylicacid
3(1(2methoxyethyl)35dimethylpyrazol4yl)1Hpyrazole5carboxylicacid
CC1=C(C(=NN1CCOC)C)C2=NNC(=C2)C(=O)O
COCCn1nc(c(c1C)c1(nH)nc(c1)C(=O)O)C
COCCn1nc(c(c1C)c1n(nH)c(c1)C(=O)O)C
InChI=1SC12H16N4O3c1711(8(2)16(157)45193)9610(12(17)18)14139h6H45H213H3(H1314)(H1718)
MFCD30709851
ZINC000217043377
ZINC217043377

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Available files

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