Vitas-M small molecule compound

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

Catalog ID
STK005938
SMILES Clc1cccc(c1Cn1c(NCCc2ccccc2)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 C22H21Cl2N5O2 MW 458.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N5O2/c1-27-19-18(20(30)28(2)22(27)31)29(13-15-16(23)9-6-10-17(15)24)21(26-19)25-12-11-14-7-4-3-5-8-14/h3-10H,11-13H2,1-2H3,(H,25,26)
InChIKey
CBDPIWBQVCRJAA-UHFFFAOYSA-N
Synonyms
317843-61-1
317843611
7((26dichlorophenyl)methyl)13dimethyl8(2phenylethylamino)purine26dione
7((26DICHLOROPHENYL)METHYL)13DIMETHYL8(PHENETHYLAMINO)PURINE26DIONE
7(26DICHLOROBENZYL)13DIMETHYL8((2PHENYLETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
7(26dichlorobenzyl)13dimethyl8(phenethylamino)1Hpurine26(3H7H)dione
Clc1cccc(c1Cn1c(NCCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)Cl
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCC3=CC=CC=C3)CC4=C(C=CC=C4Cl)Cl
InChI=1SC22H21Cl2N5O2c1271918(20(30)28(2)22(27)31)29(131516(23)961017(15)24)21(2619)251211147435814h310H1113H212H3(H2526)
MFCD01556450
STK005938
ZINC000008916425
ZINC08916425
ZINC8916425

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Available files

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