Vitas-M small molecule compound
2',6'-dihydroxy-3-(4-methoxyphenyl)-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Catalog ID
STK584987
SMILES COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2cccc3)C(=NC(=NC1=O)O)O
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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 C22H22N4O4 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4/c1-30-16-8-6-15(7-9-16)25-10-11-26-17-5-3-2-4-14(17)12-22(18(26)13-25)19(27)23-21(29)24-20(22)28/h2-9,18H,10-13H2,1H3,(H2,23,24,27,28,29)InChIKey
JVMGDUNMZYZFNT-UHFFFAOYSA-NSynonyms
879456-84-526dihydroxy3(4methoxyphenyl)2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidin)4one
3(4methoxyphenyl)spiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
879456845
COC1=CC=C(C=C1)N2CCN3C(C2)C4(CC5=CC=CC=C53)C(=O)NC(=O)NC4=O
InChI=1SC22H22N4O4c130168615(7916)2510112617532414(17)1222(18(26)1325)19(27)2321(29)2420(22)28h2918H1013H21H3(H22324272829)
MFCD07203831
ZINC000016993968
ZINC000245326407
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