Vitas-M small molecule compound
1-[2-(3,4-diethoxyphenyl)ethyl]-7-(3-fluorophenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STK678485
SMILES CCOc1cc(ccc1OCC)CCn1c(=O)[nH]c(=O)c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccc(c1)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 C26H23F7N4O4 MW 588.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F7N4O4/c1-3-40-17-9-8-14(12-18(17)41-4-2)10-11-37-21-19(22(38)35-23(37)39)24(25(28,29)30,26(31,32)33)36-20(34-21)15-6-5-7-16(27)13-15/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,34,36)(H,35,38,39)InChIKey
VXQACFXTRPVJHL-UHFFFAOYSA-NSynonyms
1(2(34diethoxyphenyl)ethyl)7(3fluorophenyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidine24(1H3H)dione
1(2(34DIETHOXYPHENYL)ETHYL)7(3FLUOROPHENYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
CCOC1=C(C=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC(=CC=C4)F)(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)c1cccc(c1)F
InChI=1SC26H23F7N4O4c1340179814(1218(17)4142)1011372119(22(38)3523(37)39)24(25(2829)3026(3132)33)3620(3421)1565716(27)1315h591213H341011H212H3(H3436)(H353839)
MFCD03308202
ZINC000003618634
ZINC3618634
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.