Vitas-M small molecule compound

1,3-dimethyl-7-(3-methylbenzyl)-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK838943
SMILES Cc1cccc(c1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1

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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 C25H28N6O2 MW 444.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O2/c1-18-8-7-9-19(16-18)17-31-21-22(27(2)25(33)28(3)23(21)32)26-24(31)30-14-12-29(13-15-30)20-10-5-4-6-11-20/h4-11,16H,12-15,17H2,1-3H3
InChIKey
KKSOHENWFLATRN-UHFFFAOYSA-N
Synonyms
378204-70-7
13DIMETHYL7((3METHYLPHENYL)METHYL)8(4PHENYLPIPERAZIN1YL)PURINE26DIONE
13DIMETHYL7((3METHYLPHENYL)METHYL)8(4PHENYLPIPERAZINYL)137TRIHYDROPURINE26DIONE
13DIMETHYL7(3METHYLBENZYL)8(4PHENYLPIPERAZIN1YL)1HPURINE26(3H7H)DIONE
13dimethyl7(3methylbenzyl)8(4phenylpiperazin1yl)37dihydro1Hpurine26dione
13DIMETHYL7(3METHYLBENZYL)8(4PHENYLPIPERAZIN1YL)37DIHYDROPURINE26DIONE
378204707
CC1=CC(=CC=C1)CN2C3=C(N=C2N4CCN(CC4)C5=CC=CC=C5)N(C(=O)N(C3=O)C)C
InChI=1SC25H28N6O2c11887919(1618)17312122(27(2)25(33)28(3)23(21)32)2624(31)30141229(131530)20105461120h41116H121517H213H3
MFCD02984681
ZINC000000629037
ZINC00629037
ZINC629037

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Available files

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