Vitas-M small molecule compound
5-{[4-(benzyloxy)-3-bromo-5-ethoxybenzyl]amino}-2-(morpholin-4-yl)benzoic acid
Catalog ID
STK171762
SMILES CCOc1cc(CNc2ccc(c(c2)C(=O)O)N2CCOCC2)cc(c1OCc1ccccc1)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 C27H29BrN2O5 MW 541.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29BrN2O5/c1-2-34-25-15-20(14-23(28)26(25)35-18-19-6-4-3-5-7-19)17-29-21-8-9-24(22(16-21)27(31)32)30-10-12-33-13-11-30/h3-9,14-16,29H,2,10-13,17-18H2,1H3,(H,31,32)InChIKey
LSWNCQAJLBBAQN-UHFFFAOYSA-NSynonyms
5((3BROMO5ETHOXY4PHENYLMETHOXYPHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOICACID
5((4(BENZYLOXY)3BROMO5ETHOXYBENZYL)AMINO)2(MORPHOLIN4YL)BENZOICACID
CCOC1=C(C(=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O)Br)OCC4=CC=CC=C4
InChI=1SC27H29BrN2O5c1234251520(1423(28)26(25)3518196435719)1729218924(22(1621)27(31)32)30101233131130h39141629H210131718H21H3(H3132)
MFCD06663490
ZINC000097946044
ZINC97946044
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