Vitas-M small molecule compound

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

Catalog ID
STL004844
SMILES CCCCCn1c(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 C27H33N5O2 MW 459.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N5O2/c1-4-5-12-17-32-23(28-25-24(32)26(33)30(3)27(34)29(25)2)20-31(18-21-13-8-6-9-14-21)19-22-15-10-7-11-16-22/h6-11,13-16H,4-5,12,17-20H2,1-3H3
InChIKey
CRNRECBODNKYBD-UHFFFAOYSA-N
Synonyms
586987-60-2
586987602
8((BISBENZYLAMINO)METHYL)13DIMETHYL7PENTYL137TRIHYDROPURINE26DIONE
8((dibenzylamino)methyl)13dimethyl7pentyl1Hpurine26(3H7H)dione
8((dibenzylamino)methyl)13dimethyl7pentyl37dihydro1Hpurine26dione
8((DIBENZYLAMINO)METHYL)13DIMETHYL7PENTYLPURINE26DIONE
CCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN(CC3=CC=CC=C3)CC4=CC=CC=C4
InChI=1SC27H33N5O2c14512173223(282524(32)26(33)30(3)27(34)29(25)2)2031(1821138691421)192215107111622h6111316H45121720H213H3
MFCD04031093
ZINC000057010929
ZINC57010929

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Available files

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