Vitas-M small molecule compound

7-(3-hydroxypropyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK580162
SMILES OCCCn1c(CN2CCN(CC2)c2ccc(cc2)OC)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 C22H30N6O4 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N6O4/c1-24-20-19(21(30)25(2)22(24)31)28(9-4-14-29)18(23-20)15-26-10-12-27(13-11-26)16-5-7-17(32-3)8-6-16/h5-8,29H,4,9-15H2,1-3H3
InChIKey
FOKZZOLWRBZXKB-UHFFFAOYSA-N
Synonyms
851941-54-3
7(3hydroxypropyl)8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7(3hydroxypropyl)8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
7(3HYDROXYPROPYL)8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7(3HYDROXYPROPYL)8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
851941543
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)OC)CCCO
InChI=1SC22H30N6O4c1242019(21(30)25(2)22(24)31)28(941429)18(2320)1526101227(131126)165717(323)8616h5829H4915H213H3
MFCD04466640
ZINC000057105626
ZINC57105626

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Available files

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