Vitas-M small molecule compound

methyl 1,3,7-trimethyl-5-(4-methylphenyl)-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate

Catalog ID
STK981380
SMILES COC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)C)c(=O)n(c(=O)n2C)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 C19H21N3O4 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4/c1-10-6-8-12(9-7-10)14-13(18(24)26-5)11(2)20-16-15(14)17(23)22(4)19(25)21(16)3/h6-9,14,20H,1-5H3
InChIKey
XGXYOHWMBXUWGT-UHFFFAOYSA-N
Synonyms
380461-59-6
380461596
CC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OC)C)N(C(=O)N(C3=O)C)C
InChI=1SC19H21N3O4c1106812(9710)1413(18(24)265)11(2)201615(14)17(23)22(4)19(25)21(16)3h691420H15H3
methyl137trimethyl5(4methylphenyl)24dioxo123458hexahydropyrido(23d)pyrimidine6carboxylate
METHYL137TRIMETHYL5(4METHYLPHENYL)24DIOXO58DIHYDROPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
MFCD03133014
ZINC000013636235
ZINC000013636238

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Available files

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