Vitas-M small molecule compound
benzyl {1-[(5-bromo-2-propoxyphenyl)carbonyl]-3-oxopiperazin-2-yl}acetate
Catalog ID
STL066179
SMILES CCCOc1ccc(cc1C(=O)N1CCNC(=O)C1CC(=O)OCc1ccccc1)Br
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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 C23H25BrN2O5 MW 489.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrN2O5/c1-2-12-30-20-9-8-17(24)13-18(20)23(29)26-11-10-25-22(28)19(26)14-21(27)31-15-16-6-4-3-5-7-16/h3-9,13,19H,2,10-12,14-15H2,1H3,(H,25,28)InChIKey
BAGHBNSLYMKCRN-UHFFFAOYSA-NSynonyms
benzyl(1((5bromo2propoxyphenyl)carbonyl)3oxopiperazin2yl)acetate
benzyl2(1(5bromo2propoxybenzoyl)3oxopiperazin2yl)acetate
CCCOC1=C(C=C(C=C1)Br)C(=O)N2CCNC(=O)C2CC(=O)OCC3=CC=CC=C3
InChI=1SC23H25BrN2O5c121230209817(24)1318(20)23(29)2611102522(28)19(26)1421(27)3115166435716h391319H210121415H21H3(H2528)
MFCD07550171
ZINC000012137724
ZINC000012137725
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