Vitas-M small molecule compound

(5Z)-5-[4-(azepan-1-yl)benzylidene]-3-(4-bromophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STK562842
SMILES Brc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O)O

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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 C23H22BrN3O3 MW 468.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3/c24-17-7-11-19(12-8-17)27-22(29)20(21(28)25-23(27)30)15-16-5-9-18(10-6-16)26-13-3-1-2-4-14-26/h5-12,15H,1-4,13-14H2,(H,25,28,30)/b20-15-
InChIKey
QYUQTFAPLDFUSX-HKWRFOASSA-N
Synonyms
672916-12-0
672916120
Brc1ccc(cc1)N1C(=O)N=C(C(=Cc2ccc(cc2)N2CCCCCC2)C1=O)O
MFCD04075798
ZINC000017195534

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Available files

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