Vitas-M small molecule compound
8-[(1,3-benzodioxol-5-ylmethyl)amino]-7-(2,6-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK804498
SMILES Clc1cccc(c1Cn1c(NCc2ccc3c(c2)OCO3)nc2c1c(=O)n(c(=O)n2C)C)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 C22H19Cl2N5O4 MW 488.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2N5O4/c1-27-19-18(20(30)28(2)22(27)31)29(10-13-14(23)4-3-5-15(13)24)21(26-19)25-9-12-6-7-16-17(8-12)33-11-32-16/h3-8H,9-11H2,1-2H3,(H,25,26)InChIKey
HEAHETBZISRQSM-UHFFFAOYSA-NSynonyms
317843-20-2317843202
8((13benzodioxol5ylmethyl)amino)7(26dichlorobenzyl)13dimethyl37dihydro1Hpurine26dione
8((benzo(d)(13)dioxol5ylmethyl)amino)7(26dichlorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(13BENZODIOXOL5YLMETHYLAMINO)7((26DICHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CC4=C(C=C3)OCO4)CC5=C(C=CC=C5Cl)Cl
InChI=1SC22H19Cl2N5O4c1271918(20(30)28(2)22(27)31)29(101314(23)43515(13)24)21(2619)25912671617(812)33113216h38H911H212H3(H2526)
MFCD01556414
ZINC000008934450
ZINC08934450
ZINC8934450
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