Vitas-M small molecule compound

1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL003228
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCCc1ccccc1)c(n2)CN1CCCCC1

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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 C22H29N5O2 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2/c1-24-20-19(21(28)25(2)22(24)29)27(15-9-12-17-10-5-3-6-11-17)18(23-20)16-26-13-7-4-8-14-26/h3,5-6,10-11H,4,7-9,12-16H2,1-2H3
InChIKey
MATNVDGFLMKNBU-UHFFFAOYSA-N
Synonyms
579446-41-6
13dimethyl7(3phenylpropyl)8(piperidin1ylmethyl)1Hpurine26(3H7H)dione
13dimethyl7(3phenylpropyl)8(piperidin1ylmethyl)37dihydro1Hpurine26dione
13DIMETHYL7(3PHENYLPROPYL)8(PIPERIDIN1YLMETHYL)PURINE26DIONE
13DIMETHYL7(3PHENYLPROPYL)8(PIPERIDYLMETHYL)137TRIHYDROPURINE26DIONE
13DIMETHYL7(3PHENYLPROPYL)8PIPERIDIN1YLMETHYL37DIHYDROPURINE26DIONE
579446416
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCCCC3)CCCC4=CC=CC=C4
InChI=1SC22H29N5O2c1242019(21(28)25(2)22(24)29)27(1591217105361117)18(2320)1626137481426h3561011H4791216H212H3
MFCD03087671
ZINC000004103535
ZINC4103535

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Available files

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