Vitas-M small molecule compound

9-methyl-1,7-bis(2-oxopropyl)-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione

Catalog ID
STK858118
SMILES CC(=O)CN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)C)c1ccccc1

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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 C20H20N6O4 MW 408.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O4/c1-12(27)9-25-18(29)16-17(23(3)20(25)30)21-19-24(16)11-15(14-7-5-4-6-8-14)22-26(19)10-13(2)28/h4-8H,9-11H2,1-3H3
InChIKey
XGLQSCFTPFAHHZ-UHFFFAOYSA-N
Synonyms
898410-43-0
17BIS(2OXOPROPYL)9METHYL3PHENYL579TRIHYDRO4H124TRIAZINO(43H)PURINE68DIONE
898410430
9methyl17bis(2oxopropyl)3phenyl14dihydro(124)triazino(34f)purine68(7H9H)dione
9methyl17bis(2oxopropyl)3phenyl4Hpurino(87c)(124)triazine68dione
9METHYL17BIS(2OXOPROPYL)3PHENYL79DIHYDRO(124)TRIAZINO(34F)PURINE68(1H4H)DIONE
CC(=O)CN1C(=O)C2=C(N=C3N2CC(=NN3CC(=O)C)C4=CC=CC=C4)N(C1=O)C
InChI=1SC20H20N6O4c112(27)92518(29)1617(23(3)20(25)30)211924(16)1115(147546814)2226(19)1013(2)28h48H911H213H3
MFCD08014257
ZINC000005148186
ZINC05148186
ZINC5148186

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.