Vitas-M small molecule compound

1-benzyl-7-(2-fluorophenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK769580
SMILES Fc1ccccc1C1=NC(c2c(N1)n(Cc1ccccc1)c(=O)[nH]c2=O)(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 C21H13F7N4O2 MW 486.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13F7N4O2/c22-13-9-5-4-8-12(13)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,29,31)(H,30,33,34)
InChIKey
XZAQTXOMVJMOAI-UHFFFAOYSA-N
Synonyms

1benzyl7(2fluorophenyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidine24(1H3H)dione
1BENZYL7(2FLUOROPHENYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
C1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC=CC=C4F)(C(F)(F)F)C(F)(F)F
Fc1ccccc1C1=NC(c2c(N1)n(Cc1ccccc1)c(=O)(nH)c2=O)(C(F)(F)F)C(F)(F)F
InChI=1SC21H13F7N4O2c2213954812(13)15291614(19(311520(2324)25)21(2627)28)17(33)3018(34)32(16)10116213711h19H10H2(H2931)(H303334)
MFCD03409358
ZINC000012376609
ZINC12376609

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Available files

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