Vitas-M small molecule compound

1-(2,4-dichlorobenzyl)-8-[(1-hydroxypropan-2-yl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK697654
SMILES OCC(Nc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccc(cc1Cl)Cl)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 C17H19Cl2N5O3 MW 412.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19Cl2N5O3/c1-9(8-25)20-16-21-14-13(22(16)2)15(26)24(17(27)23(14)3)7-10-4-5-11(18)6-12(10)19/h4-6,9,25H,7-8H2,1-3H3,(H,20,21)
InChIKey
VCBVXNSKPMNRJF-UHFFFAOYSA-N
Synonyms
317842-88-9
1((24DICHLOROPHENYL)METHYL)8(1HYDROXYPROPAN2YLAMINO)37DIMETHYLPURINE26DIONE
1(24dichlorobenzyl)8((1hydroxypropan2yl)amino)37dimethyl1Hpurine26(3H7H)dione
1(24dichlorobenzyl)8((1hydroxypropan2yl)amino)37dimethyl37dihydro1Hpurine26dione
317842889
CC(CO)NC1=NC2=C(N1C)C(=O)N(C(=O)N2C)CC3=C(C=C(C=C3)Cl)Cl
InChI=1SC17H19Cl2N5O3c19(825)2016211413(22(16)2)15(26)24(17(27)23(14)3)7104511(18)612(10)19h46925H78H213H3(H2021)
MFCD01556389
ZINC000013739119
ZINC000013739120

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Available files

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