Vitas-M small molecule compound

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

Catalog ID
STK526177
SMILES Clc1cccc(c1Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C)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 C14H11Cl3N4O2 MW 373.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11Cl3N4O2/c1-19-11-10(12(22)20(2)14(19)23)21(13(17)18-11)6-7-8(15)4-3-5-9(7)16/h3-5H,6H2,1-2H3
InChIKey
GHLRQEIQXZGUMS-UHFFFAOYSA-N
Synonyms
305862-86-6
305862866
8CHLORO7((26DICHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8chloro7(26dichlorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8chloro7(26dichlorobenzyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC3=C(C=CC=C3Cl)Cl
InChI=1SC14H11Cl3N4O2c1191110(12(22)20(2)14(19)23)21(13(17)1811)678(15)4359(7)16h35H6H212H3
MFCD00836312
ZINC000001101491
ZINC01101491
ZINC1101491

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Available files

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