Vitas-M small molecule compound

5-[(4-benzylpiperazin-1-yl)sulfonyl]-6-methylpyrimidine-2,4-diol

Catalog ID
STK634025
SMILES Oc1nc(C)c(c(n1)O)S(=O)(=O)N1CCN(CC1)Cc1ccccc1

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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 C16H20N4O4S MW 364.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4S/c1-12-14(15(21)18-16(22)17-12)25(23,24)20-9-7-19(8-10-20)11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H2,17,18,21,22)
InChIKey
ZXSQHCDZFWAXCU-UHFFFAOYSA-N
Synonyms
928746-56-9
5((4benzylpiperazin1yl)sulfonyl)6methylpyrimidine24diol
5(4benzylpiperazin1yl)sulfonyl6methyl1Hpyrimidine24dione
928746569
CC1=C(C(=O)NC(=O)N1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3
InChI=1SC16H20N4O4Sc11214(15(21)1816(22)1712)25(2324)209719(81020)11135324613h26H711H21H3(H217182122)
MFCD18160274
ZINC000020676790
ZINC20676790

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Available files

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