Vitas-M small molecule compound

7-(2,3-dihydroxypropyl)-6-hydroxy-3-methyl-8-[(2-phenylethyl)amino]-3,7-dihydro-2H-purin-2-one

Catalog ID
STK640100
SMILES OCC(Cn1c(NCCc2ccccc2)nc2c1c(O)nc(=O)n2C)O

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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 C17H21N5O4 MW 359.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O4/c1-21-14-13(15(25)20-17(21)26)22(9-12(24)10-23)16(19-14)18-8-7-11-5-3-2-4-6-11/h2-6,12,23-24H,7-10H2,1H3,(H,18,19)(H,20,25,26)
InChIKey
PQWIYMGDCMNOBE-UHFFFAOYSA-N
Synonyms
335403-81-1
335403811
7(23dihydroxypropyl)3methyl8(2phenylethylamino)purine26dione
7(23DIHYDROXYPROPYL)3METHYL8(PHENETHYLAMINO)PURINE26DIONE
7(23DIHYDROXYPROPYL)3METHYL8PHENETHYLAMINO37DIHYDROPURINE26DIONE
7(23dihydroxypropyl)6hydroxy3methyl8((2phenylethyl)amino)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCC3=CC=CC=C3)CC(CO)O
InChI=1SC17H21N5O4c1211413(15(25)2017(21)26)22(912(24)1023)16(1914)1887115324611h26122324H710H21H3(H1819)(H202526)
MFCD18162223
ZINC000000626068
ZINC000000626070
ZINC00626068
ZINC00626070

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Available files

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