Vitas-M small molecule compound

8-[(dibenzylamino)methyl]-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL339954
SMILES O=C(c1ccccc1)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)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 C30H29N5O3 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O3/c1-32-28-27(29(37)33(2)30(32)38)35(20-25(36)24-16-10-5-11-17-24)26(31-28)21-34(18-22-12-6-3-7-13-22)19-23-14-8-4-9-15-23/h3-17H,18-21H2,1-2H3
InChIKey
WLLOYLCQGOXFAA-UHFFFAOYSA-N
Synonyms
843623-47-2
8((BISBENZYLAMINO)METHYL)13DIMETHYL7(2OXO2PHENYLETHYL)137TRIHYDROPURINE26DIONE
8((dibenzylamino)methyl)13dimethyl7(2oxo2phenylethyl)1Hpurine26(3H7H)dione
8((dibenzylamino)methyl)13dimethyl7(2oxo2phenylethyl)37dihydro1Hpurine26dione
8((DIBENZYLAMINO)METHYL)13DIMETHYL7PHENACYLPURINE26DIONE
843623472
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN(CC3=CC=CC=C3)CC4=CC=CC=C4)CC(=O)C5=CC=CC=C5
InChI=1SC30H29N5O3c1322827(29(37)33(2)30(32)38)35(2025(36)2416105111724)26(3128)2134(1822126371322)1923148491523h317H1821H212H3
MFCD04015538
ZINC000057010920
ZINC57010920

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Available files

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