Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-8-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK848034
SMILES Fc1cccc(c1Cn1c(CN2CCc3c(C2)cccc3)nc2c1c(=O)n(c(=O)n2C)C)Cl
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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 C24H23ClFN5O2 MW 467.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClFN5O2/c1-28-22-21(23(32)29(2)24(28)33)31(13-17-18(25)8-5-9-19(17)26)20(27-22)14-30-11-10-15-6-3-4-7-16(15)12-30/h3-9H,10-14H2,1-2H3InChIKey
FLKRYZOMNAGFFS-UHFFFAOYSA-NSynonyms
851938-69-77((2CHLORO6FLUOROPHENYL)METHYL)8(34DIHYDRO1HISOQUINOLIN2YLMETHYL)13DIMETHYLPURINE26DIONE
7(2CHLORO6FLUOROBENZYL)8((34DIHYDROISOQUINOLIN2(1H)YL)METHYL)13DIMETHYL1HPURINE26(3H7H)DIONE
7(2chloro6fluorobenzyl)8(34dihydroisoquinolin2(1H)ylmethyl)13dimethyl37dihydro1Hpurine26dione
851938697
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCC4=CC=CC=C4C3)CC5=C(C=CC=C5Cl)F
InChI=1SC24H23ClFN5O2c1282221(23(32)29(2)24(28)33)31(131718(25)85919(17)26)20(2722)1430111015634716(15)1230h39H1014H212H3
MFCD04466367
ZINC000020533419
ZINC20533419
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