Vitas-M small molecule compound

ethyl 6-[(4-acetylpiperazin-1-yl)methyl]-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK986921
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(=O)C)NC(=O)NC1c1ccc(cc1)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 C21H28N4O4 MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4/c1-4-29-20(27)18-17(13-24-9-11-25(12-10-24)15(3)26)22-21(28)23-19(18)16-7-5-14(2)6-8-16/h5-8,19H,4,9-13H2,1-3H3,(H2,22,23,28)
InChIKey
MYAAVRAEYRUKOW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C)CN3CCN(CC3)C(=O)C
ethyl6((4acetylpiperazin1yl)methyl)4(4methylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4acetylpiperazin1yl)methyl)4(4methylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H28N4O4c142920(27)1817(132491125(121024)15(3)26)2221(28)2319(18)167514(2)6816h5819H4913H213H3(H2222328)
MFCD18183789
ZINC000051318486
ZINC000051318487

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Available files

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