Vitas-M small molecule compound

8-(4-chlorophenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK697687
SMILES Clc1ccc(cc1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

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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 C13H11ClN4O2 MW 290.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11ClN4O2/c1-17-11-9(12(19)18(2)13(17)20)15-10(16-11)7-3-5-8(14)6-4-7/h3-6H,1-2H3,(H,15,16)
InChIKey
PJMZAQWLPMVOMG-UHFFFAOYSA-N
Synonyms
29064-02-6
1HPURINE26DIONE8(4CHLOROPHENYL)39DIHYDRO13DIMETHYL
29064026
8(4chlorophenyl)13dimethyl1Hpurine26(3H7H)dione
8(4chlorophenyl)13dimethyl37dihydro1Hpurine26dione
8(4CHLOROPHENYL)13DIMETHYL37DIHYDROPURINE26DIONE
8(4CHLOROPHENYL)13DIMETHYL7HPURINE26DIONE
8(4CHLOROPHENYL)13DIMETHYLXANTHINE
8(4CHLOROPHENYL)THEOPHYLLINE
Clc1ccc(cc1)c1(nH)c2c(n1)n(C)c(=O)n(c2=O)C
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)Cl
InChI=1SC13H11ClN4O2c117119(12(19)18(2)13(17)20)1510(1611)7358(14)647h36H12H3(H1516)
MFCD04017078
ZINC000017105141
ZINC17105141

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Available files

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