Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK088899
SMILES OC(c1ccccc1)CNc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)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 C22H21ClFN5O3 MW 457.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFN5O3/c1-27-19-18(20(31)28(2)22(27)32)29(12-14-15(23)9-6-10-16(14)24)21(26-19)25-11-17(30)13-7-4-3-5-8-13/h3-10,17,30H,11-12H2,1-2H3,(H,25,26)InChIKey
IUFMAZJSPYIREG-UHFFFAOYSA-NSynonyms
353506-94-2353506942
7((2CHLORO6FLUOROPHENYL)METHYL)8((2HYDROXY2PHENYLETHYL)AMINO)13DIMETHYLPURINE26DIONE
7(2chloro6fluorobenzyl)8((2hydroxy2phenylethyl)amino)13dimethyl1Hpurine26(3H7H)dione
7(2CHLORO6FLUOROBENZYL)8((2HYDROXY2PHENYLETHYL)AMINO)13DIMETHYL37DIHYDRO1HPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC(C3=CC=CC=C3)O)CC4=C(C=CC=C4Cl)F
InChI=1SC22H21ClFN5O3c1271918(20(31)28(2)22(27)32)29(121415(23)961016(14)24)21(2619)251117(30)137435813h3101730H1112H212H3(H2526)
MFCD01554433
OC(c1ccccc1)CNc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C
STK088899
ZINC000002300508
ZINC000002300509
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