Vitas-M small molecule compound

6-hydroxy-4-(4-methoxyphenyl)-1-methyl-5-(phenylcarbonyl)-6-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one

Catalog ID
STL090911
SMILES COc1ccc(cc1)C1NC(=O)N(C(C1C(=O)c1ccccc1)(O)C(F)(F)F)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 C20H19F3N2O4 MW 408.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O4/c1-25-18(27)24-16(12-8-10-14(29-2)11-9-12)15(19(25,28)20(21,22)23)17(26)13-6-4-3-5-7-13/h3-11,15-16,28H,1-2H3,(H,24,27)
InChIKey
NNPDITMUQOSOIH-UHFFFAOYSA-N
Synonyms

5benzoyl6hydroxy4(4methoxyphenyl)1methyl6(trifluoromethyl)13diazinan2one
6hydroxy4(4methoxyphenyl)1methyl5(phenylcarbonyl)6(trifluoromethyl)tetrahydropyrimidin2(1H)one
CN1C(=O)NC(C(C1(C(F)(F)F)O)C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC
InChI=1SC20H19F3N2O4c12518(27)2416(1281014(292)11912)15(19(2528)20(2122)23)17(26)136435713h311151628H12H3(H2427)
MFCD03133399
ZINC000007986598
ZINC000245246783

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Available files

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