Vitas-M small molecule compound
1-(4-chlorophenyl)-4-hydroxy-7-(3-methoxyphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Catalog ID
STK560937
SMILES COc1cccc(c1)C1=NC(c2c(N1)n(c1ccc(cc1)Cl)c(=O)nc2O)(C(F)(F)F)C(F)(F)F
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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 C21H13ClF6N4O3 MW 518.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClF6N4O3/c1-35-13-4-2-3-10(9-13)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)12-7-5-11(22)6-8-12/h2-9H,1H3,(H,29,31)(H,30,33,34)InChIKey
CAUAFWWOMUGIMM-UHFFFAOYSA-NSynonyms
606923-69-71(4chlorophenyl)4hydroxy7(3methoxyphenyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidin2(1H)one
606923697
COC1=CC=CC(=C1)C2=NC(C3=C(N2)N(C(=O)NC3=O)C4=CC=C(C=C4)Cl)(C(F)(F)F)C(F)(F)F
InChI=1SC21H13ClF6N4O3c1351342310(913)15291614(19(311520(2324)25)21(2627)28)17(33)3018(34)32(16)127511(22)6812h29H1H3(H2931)(H303334)
MFCD04081554
ZINC000053319514
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