Vitas-M small molecule compound

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

Catalog ID
STK059864
SMILES Clc1ccccc1Cn1c(NCCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)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 C22H22ClN5O2 MW 423.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O2/c1-26-19-18(20(29)27(2)22(26)30)28(14-16-10-6-7-11-17(16)23)21(25-19)24-13-12-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3,(H,24,25)
InChIKey
OHDPAVTYSFBIOK-UHFFFAOYSA-N
Synonyms
330828-33-6
330828336
7((2chlorophenyl)methyl)13dimethyl8(2phenylethylamino)purine26dione
7((2CHLOROPHENYL)METHYL)13DIMETHYL8(PHENETHYLAMINO)PURINE26DIONE
7(2CHLOROBENZYL)13DIMETHYL8((2PHENYLETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
7(2chlorobenzyl)13dimethyl8(phenethylamino)1Hpurine26(3H7H)dione
Clc1ccccc1Cn1c(NCCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCC3=CC=CC=C3)CC4=CC=CC=C4Cl
InChI=1SC22H22ClN5O2c1261918(20(29)27(2)22(26)30)28(141610671117(16)23)21(2519)241312158435915h311H1214H212H3(H2425)
MFCD01554301
STK059864
ZINC000008926330
ZINC08926330
ZINC8926330

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Available files

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