Vitas-M small molecule compound

1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK804409
SMILES CC(c1ccc(cc1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)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 C16H18N4O2 MW 298.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O2/c1-9(2)10-5-7-11(8-6-10)13-17-12-14(18-13)19(3)16(22)20(4)15(12)21/h5-9H,1-4H3,(H,17,18)
InChIKey
ZUJGXFRFKXBIRG-UHFFFAOYSA-N
Synonyms
93214-86-9
13dimethyl8(4(propan2yl)phenyl)37dihydro1Hpurine26dione
13DIMETHYL8(4PROPAN2YLPHENYL)7HPURINE26DIONE
13DIMETHYL8PCUMENYL7HPURINE26QUINONE
8(4isopropylphenyl)13dimethyl1Hpurine26(3H7H)dione
8(4ISOPROPYLPHENYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
8(4ISOPROPYLPHENYL)13DIMETHYL37DIHYDROPURINE26DIONE
93214869
CC(C)C1=CC=C(C=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C
CC(c1ccc(cc1)c1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)C
InChI=1SC16H18N4O2c19(2)105711(8610)13171214(1813)19(3)16(22)20(4)15(12)21h59H14H3(H1718)
MFCD02930391
ZINC000004019695
ZINC04019695
ZINC4019695

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Available files

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