Vitas-M small molecule compound
1-(2-chlorobenzyl)-8-[(2,3-dihydroxypropyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL295982
SMILES OCC(CNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1Cl)O
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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 C17H20ClN5O4 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN5O4/c1-21-13-14(20-16(21)19-7-11(25)9-24)22(2)17(27)23(15(13)26)8-10-5-3-4-6-12(10)18/h3-6,11,24-25H,7-9H2,1-2H3,(H,19,20)InChIKey
CXVIOGOLALTIPK-UHFFFAOYSA-NSynonyms
317843-28-01((2CHLOROPHENYL)METHYL)8(23DIHYDROXYPROPYLAMINO)37DIMETHYLPURINE26DIONE
1(2chlorobenzyl)8((23dihydroxypropyl)amino)37dimethyl1Hpurine26(3H7H)dione
1(2chlorobenzyl)8((23dihydroxypropyl)amino)37dimethyl37dihydro1Hpurine26dione
317843280
CN1C2=C(N=C1NCC(CO)O)N(C(=O)N(C2=O)CC3=CC=CC=C3Cl)C
InChI=1SC17H20ClN5O4c1211314(2016(21)19711(25)924)22(2)17(27)23(15(13)26)810534612(10)18h36112425H79H212H3(H1920)
MFCD00837007
ZINC000013739124
ZINC000013739126
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