Vitas-M small molecule compound

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

Catalog ID
STK678327
SMILES CCOc1cc(ccc1OCC)CCn1c(=O)[nH]c(=O)c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1ccc(cc1)Cl

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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 C26H23ClF6N4O4 MW 604.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClF6N4O4/c1-3-40-17-10-5-14(13-18(17)41-4-2)11-12-37-21-19(22(38)35-23(37)39)24(25(28,29)30,26(31,32)33)36-20(34-21)15-6-8-16(27)9-7-15/h5-10,13H,3-4,11-12H2,1-2H3,(H,34,36)(H,35,38,39)
InChIKey
VTZNGBPIOAMMHE-UHFFFAOYSA-N
Synonyms

7(4chlorophenyl)1(2(34diethoxyphenyl)ethyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidine24(1H3H)dione
7(4CHLOROPHENYL)1(2(34DIETHOXYPHENYL)ETHYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
CCOC1=C(C=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC=C(C=C4)Cl)(C(F)(F)F)C(F)(F)F)OCC
CCOc1cc(ccc1OCC)CCn1c(=O)(nH)c(=O)c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1ccc(cc1)Cl
InChI=1SC26H23ClF6N4O4c13401710514(1318(17)4142)1112372119(22(38)3523(37)39)24(25(2829)3026(3132)33)3620(3421)156816(27)9715h51013H341112H212H3(H3436)(H353839)
MFCD03034515
ZINC000098003687
ZINC98003687

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Available files

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