Vitas-M small molecule compound

8-chloro-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK855898
SMILES Cc1ccccc1Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

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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 C15H15ClN4O2 MW 318.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN4O2/c1-9-6-4-5-7-10(9)8-20-11-12(17-14(20)16)18(2)15(22)19(3)13(11)21/h4-7H,8H2,1-3H3
InChIKey
DEDDPQPYPOGMRX-UHFFFAOYSA-N
Synonyms
133193-05-2
133193052
8CHLORO13DIMETHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
8chloro13dimethyl7(2methylbenzyl)1Hpurine26(3H7H)dione
8chloro13dimethyl7(2methylbenzyl)37dihydro1Hpurine26dione
8CHLORO13DIMETHYL7(2METHYLBENZYL)37DIHYDROPURINE26DIONE
CC1=CC=CC=C1CN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C
InChI=1SC15H15ClN4O2c19645710(9)8201112(1714(20)16)18(2)15(22)19(3)13(11)21h47H8H213H3
MFCD01873197
ZINC000000226691
ZINC00226691
ZINC226691

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.