Vitas-M small molecule compound

7-benzyl-8-(3,5-dimethyl-1H-pyrazol-1-yl)-1-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK942912
SMILES COCCn1c(=O)n(C)c2c(c1=O)n(Cc1ccccc1)c(n2)n1nc(cc1C)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 C21H24N6O3 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O3/c1-14-12-15(2)27(23-14)20-22-18-17(26(20)13-16-8-6-5-7-9-16)19(28)25(10-11-30-4)21(29)24(18)3/h5-9,12H,10-11,13H2,1-4H3
InChIKey
RYKVXOBNAUOPPW-UHFFFAOYSA-N
Synonyms
1020454-51-6
1020454516
7BENZYL8(35DIMETHYL1HPYRAZOL1YL)1(2METHOXYETHYL)3METHYL1HPURINE26(3H7H)DIONE
7benzyl8(35dimethyl1Hpyrazol1yl)1(2methoxyethyl)3methyl37dihydro1Hpurine26dione
7benzyl8(35dimethylpyrazol1yl)1(2methoxyethyl)3methylpurine26dione
8(35DIMETHYLPYRAZOLYL)1(2METHOXYETHYL)3METHYL7BENZYL137TRIHYDROPURINE26DIONE
CC1=CC(=NN1C2=NC3=C(N2CC4=CC=CC=C4)C(=O)N(C(=O)N3C)CCOC)C
InChI=1SC21H24N6O3c1141215(2)27(2314)20221817(26(20)13168657916)19(28)25(1011304)21(29)24(18)3h5912H101113H214H3
MFCD09978109
ZINC000012231674
ZINC12231674

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Available files

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