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8-[(E)-(1-hexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1',3,3'-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

Catalog ID
STK585360
SMILES CCCCCCN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)N(C)C(=O)N(C2=O)C)/C1=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 C29H36N6O6 MW 564.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N6O6/c1-5-6-7-8-11-35-24(37)20(23(36)30-27(35)40)15-18-9-10-21-19(14-18)16-29(22-17-31(2)12-13-34(21)22)25(38)32(3)28(41)33(4)26(29)39/h9-10,14-15,22H,5-8,11-13,16-17H2,1-4H3,(H,30,36,40)/b20-15+
InChIKey
DPZSDJSIFQOLBC-HMMYKYKNSA-N
Synonyms

(E)8((1hexyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)133trimethyl12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trionehydrochloride
8((E)(1hexyl246trioxo13diazinan5ylidene)methyl)133trimethylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
8((E)(1hexyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)133trimethyl2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
CCCCCCN1C(=O)C(=CC2=CC3=C(C=C2)N4CCN(CC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)C)C(=O)NC1=O
CCCCCCN1C(=O)NC(=O)C(=Cc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)N(C)C(=O)N(C2=O)C)C1=O
CCCCCCN1C(=O)NC(=O)C(=Cc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)N(C)C(=O)N(C2=O)C)C1=OCl
InChI=1SC29H36N6O6c15678113524(37)20(23(36)3027(35)40)15189102119(1418)1629(221731(2)121334(21)22)25(38)32(3)28(41)33(4)26(29)39h910141522H5811131617H214H3(H303640)b2015+
MFCD07637956
ZINC000097968092
ZINC000097968093

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Available files

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