Vitas-M small molecule compound

6-hydroxy-8-[(4-methoxybenzyl)amino]-3-methyl-7-(2-methylbenzyl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STL052103
SMILES COc1ccc(cc1)CNc1nc2c(n1Cc1ccccc1C)c(O)nc(=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 C22H23N5O3 MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3/c1-14-6-4-5-7-16(14)13-27-18-19(26(2)22(29)25-20(18)28)24-21(27)23-12-15-8-10-17(30-3)11-9-15/h4-11H,12-13H2,1-3H3,(H,23,24)(H,25,28,29)
InChIKey
FVXCLDCYCMZCIW-UHFFFAOYSA-N
Synonyms
714291-20-0
3METHYL7(2METHYLBENZYL)8(PANISYLAMINO)XANTHINE
6hydroxy8((4methoxybenzyl)amino)3methyl7(2methylbenzyl)37dihydro2Hpurin2one
714291200
8(((4METHOXYPHENYL)METHYL)AMINO)3METHYL7((2METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8((4METHOXYBENZYL)AMINO)3METHYL7(2METHYLBENZYL)1HPURINE26(3H7H)DIONE
8((4METHOXYBENZYL)AMINO)3METHYL7(2METHYLBENZYL)37DIHYDRO1HPURINE26DIONE
8((4METHOXYPHENYL)METHYLAMINO)3METHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
CC1=CC=CC=C1CN2C3=C(N=C2NCC4=CC=C(C=C4)OC)N(C(=O)NC3=O)C
InChI=1SC22H23N5O3c114645716(14)13271819(26(2)22(29)2520(18)28)2421(27)23121581017(303)11915h411H1213H213H3(H2324)(H252829)
MFCD05730371
ZINC000001269326
ZINC01269326
ZINC1269326

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Available files

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