Vitas-M small molecule compound

7-hexyl-6-hydroxy-3-methyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK563050
SMILES CCCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)c1ccccc1

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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 C22H30N6O2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N6O2/c1-3-4-5-9-12-28-18-19(25(2)22(30)24-20(18)29)23-21(28)27-15-13-26(14-16-27)17-10-7-6-8-11-17/h6-8,10-11H,3-5,9,12-16H2,1-2H3,(H,24,29,30)
InChIKey
JXYZGKDPFLRYBL-UHFFFAOYSA-N
Synonyms
578744-92-0
578744920
7HEXYL3METHYL8(4PHENYLPIPERAZIN1YL)PURINE26DIONE
7HEXYL3METHYL8(4PHENYLPIPERAZINYL)137TRIHYDROPURINE26DIONE
7hexyl6hydroxy3methyl8(4phenylpiperazin1yl)37dihydro2Hpurin2one
CCCCCCN1C2=C(N=C1N3CCN(CC3)C4=CC=CC=C4)N(C(=O)NC2=O)C
InChI=1SC22H30N6O2c1345912281819(25(2)22(30)2420(18)29)2321(28)27151326(141627)17107681117h681011H3591216H212H3(H242930)
MFCD04075177
ZINC000002593740
ZINC02593740
ZINC2593740

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Available files

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