Vitas-M small molecule compound
5-[(3-bromo-4-ethoxy-5-methoxybenzyl)amino]-2-(morpholin-4-yl)benzoic acid
Catalog ID
STK183437
SMILES CCOc1c(Br)cc(cc1OC)CNc1ccc(c(c1)C(=O)O)N1CCOCC1
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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 C21H25BrN2O5 MW 465.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25BrN2O5/c1-3-29-20-17(22)10-14(11-19(20)27-2)13-23-15-4-5-18(16(12-15)21(25)26)24-6-8-28-9-7-24/h4-5,10-12,23H,3,6-9,13H2,1-2H3,(H,25,26)InChIKey
XTZPQJPCUFJYDJ-UHFFFAOYSA-NSynonyms
5((3BROMO4ETHOXY5METHOXYBENZYL)AMINO)2(4MORPHOLINYL)BENZOICACID
5((3BROMO4ETHOXY5METHOXYBENZYL)AMINO)2(MORPHOLIN4YL)BENZOICACID
5((3BROMO4ETHOXY5METHOXYPHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOICACID
CCOC1=C(C=C(C=C1Br)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O)OC
InChI=1SC21H25BrN2O5c13292017(22)1014(1119(20)272)1323154518(16(1215)21(25)26)2468289724h45101223H36913H212H3(H2526)
MFCD06664335
ZINC000009906129
ZINC9906129
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