Vitas-M small molecule compound

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

Catalog ID
STK020731
SMILES CCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)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 C23H36N6O2 MW 428.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H36N6O2/c1-5-6-7-8-9-10-11-12-13-14-15-28-19-20(27(4)23(31)25-21(19)30)24-22(28)29-18(3)16-17(2)26-29/h16H,5-15H2,1-4H3,(H,25,30,31)
InChIKey
YUQGSYIDDYKMEZ-UHFFFAOYSA-N
Synonyms
189126-93-0
189126930
8(35dimethyl1Hpyrazol1yl)7dodecyl3methyl1Hpurine26(3H7H)dione
8(35DIMETHYL1HPYRAZOL1YL)7DODECYL3METHYL37DIHYDRO1HPURINE26DIONE
8(35DIMETHYLPYRAZOL1YL)7DODECYL3METHYL37DIHYDROPURINE26DIONE
8(35DIMETHYLPYRAZOL1YL)7DODECYL3METHYLPURINE26DIONE
8(35DIMETHYLPYRAZOLYL)7DODECYL3METHYL137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)n1nc(cc1C)C
CCCCCCCCCCCCN1C2=C(N=C1N3C(=CC(=N3)C)C)N(C(=O)NC2=O)C
InChI=1SC23H36N6O2c156789101112131415281920(27(4)23(31)2521(19)30)2422(28)2918(3)1617(2)2629h16H515H214H3(H253031)
MFCD01032143
STK020731
ZINC000002267847
ZINC2267847

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Available files

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