Vitas-M small molecule compound

8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one

Catalog ID
STK593209
SMILES Fc1ccccc1N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O

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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 C17H19FN6O2 MW 358.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19FN6O2/c1-22-15-14(16(25)21-17(22)26)19-13(20-15)10-23-6-8-24(9-7-23)12-5-3-2-4-11(12)18/h2-5H,6-10H2,1H3,(H,19,20)(H,21,25,26)
InChIKey
QMFKASODCUHUQT-UHFFFAOYSA-N
Synonyms
838881-24-6
8((4(2FLUOROPHENYL)PIPERAZIN1YL)METHYL)3METHYL1HPURINE26(3H7H)DIONE
8((4(2FLUOROPHENYL)PIPERAZIN1YL)METHYL)3METHYL7HPURINE26DIONE
8((4(2fluorophenyl)piperazin1yl)methyl)6hydroxy3methyl37dihydro2Hpurin2one
8((4(2FLUOROPHENYL)PIPERAZINYL)METHYL)3METHYL137TRIHYDROPURINE26DIONE
838881246
CN1C2=C(C(=O)NC1=O)NC(=N2)CN3CCN(CC3)C4=CC=CC=C4F
Fc1ccccc1N1CCN(CC1)Cc1(nH)c2c(n1)n(C)c(=O)nc2O
InChI=1SC17H19FN6O2c1221514(16(25)2117(22)26)1913(2015)10236824(9723)12532411(12)18h25H610H21H3(H1920)(H212526)
MFCD07202331
ZINC000002347966
ZINC2347966

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.