Vitas-M small molecule compound
7-[(2Z)-3-chlorobut-2-en-1-yl]-6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STL055109
SMILES OCCN1CCN(CC1)c1nc2c(n1C/C=C(\Cl)/C)c(O)nc(=O)n2C
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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 C16H23ClN6O3 MW 382.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23ClN6O3/c1-11(17)3-4-23-12-13(20(2)16(26)19-14(12)25)18-15(23)22-7-5-21(6-8-22)9-10-24/h3,24H,4-10H2,1-2H3,(H,19,25,26)/b11-3-InChIKey
TZNCDNIABGOCRC-JYOAFUTRSA-NSynonyms
478252-97-0478252970
7((2Z)3chlorobut2en1yl)6hydroxy8(4(2hydroxyethyl)piperazin1yl)3methyl37dihydro2Hpurin2one
7((Z)3CHLOROBUT2ENYL)8(4(2HYDROXYETHYL)PIPERAZIN1YL)3METHYLPURINE26DIONE
7(3CHLOROBUT2EN1YL)8(4(2HYDROXYETHYL)PIPERAZIN1YL)3METHYL1HPURINE26(3H7H)DIONE
InChI=1SC16H23ClN6O3c111(17)34231213(20(2)16(26)1914(12)25)1815(23)227521(6822)91024h324H410H212H3(H192526)b113
MFCD05731894
OCCN1CCN(CC1)c1nc2c(n1CC=C(Cl)C)c(O)nc(=O)n2C
ZINC000019999769
ZINC19999769
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