Vitas-M small molecule compound
1-benzyl-4-hydroxy-7-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Catalog ID
STL149919
SMILES O=c1nc(O)c2c(n1Cc1ccccc1)NC(=NC2(C(F)(F)F)C(F)(F)F)CCc1ccccc1
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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 C23H18F6N4O2 MW 496.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18F6N4O2/c24-22(25,26)21(23(27,28)29)17-18(30-16(32-21)12-11-14-7-3-1-4-8-14)33(20(35)31-19(17)34)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,30,32)(H,31,34,35)InChIKey
TUCQDIDEGSTSNS-UHFFFAOYSA-NSynonyms
524716-40-31benzyl4hydroxy7(2phenylethyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidin2(1H)one
1BENZYL7(2PHENYLETHYL)55BIS(TRIFLUOROMETHYL)58DIHYDROPYRIMIDO(45D)PYRIMIDINE24(1H3H)DIONE
1benzyl7(2phenylethyl)55bis(trifluoromethyl)8Hpyrimido(45d)pyrimidine24dione
1BENZYL7PHENETHYL55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
C1=CC=C(C=C1)CCC2=NC(C3=C(N2)N(C(=O)NC3=O)CC4=CC=CC=C4)(C(F)(F)F)C(F)(F)F
InChI=1SC23H18F6N4O2c2422(2526)21(23(2728)29)1718(3016(3221)1211147314814)33(20(35)3119(17)34)131595261015h110H1113H2(H3032)(H313435)
MFCD04082155
ZINC000001256346
ZINC01256346
ZINC1256346
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