Vitas-M small molecule compound
1-(2-chlorobenzyl)-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK931665
SMILES CC(Cn1c(nc2c1c(=O)n(Cc1ccccc1Cl)c(=O)n2C)n1nc(cc1C)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 C22H25ClN6O2 MW 440.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN6O2/c1-13(2)11-27-18-19(24-21(27)29-15(4)10-14(3)25-29)26(5)22(31)28(20(18)30)12-16-8-6-7-9-17(16)23/h6-10,13H,11-12H2,1-5H3InChIKey
FPXBTVZGLXXCKA-UHFFFAOYSA-NSynonyms
1020454-15-21((2chlorophenyl)methyl)8(35dimethylpyrazol1yl)3methyl7(2methylpropyl)purine26dione
1(2chlorobenzyl)8(35dimethyl1Hpyrazol1yl)3methyl7(2methylpropyl)37dihydro1Hpurine26dione
1(2CHLOROBENZYL)8(35DIMETHYL1HPYRAZOL1YL)7ISOBUTYL3METHYL1HPURINE26(3H7H)DIONE
1020454152
8(35DIMETHYLPYRAZOLYL)1((2CHLOROPHENYL)METHYL)3METHYL7(2METHYLPROPYL)137TRIHYDROPURINE26DIONE
CC1=CC(=NN1C2=NC3=C(N2CC(C)C)C(=O)N(C(=O)N3C)CC4=CC=CC=C4Cl)C
InChI=1SC22H25ClN6O2c113(2)11271819(2421(27)2915(4)1014(3)2529)26(5)22(31)28(20(18)30)1216867917(16)23h61013H1112H215H3
MFCD09978091
ZINC000012231614
ZINC12231614
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