Vitas-M small molecule compound
5-({3-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-2-(morpholin-4-yl)benzoic acid
Catalog ID
STK179928
SMILES COc1cc(CNc2ccc(c(c2)C(=O)O)N2CCOCC2)ccc1OCc1ccc(cc1)C
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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 C27H30N2O5 MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5/c1-19-3-5-20(6-4-19)18-34-25-10-7-21(15-26(25)32-2)17-28-22-8-9-24(23(16-22)27(30)31)29-11-13-33-14-12-29/h3-10,15-16,28H,11-14,17-18H2,1-2H3,(H,30,31)InChIKey
GBJCYFVXRYTCJQ-UHFFFAOYSA-NSynonyms
5((3METHOXY4((4METHYLBENZYL)OXY)BENZYL)AMINO)2(MORPHOLIN4YL)BENZOICACID
5((3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOICACID
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)CNC3=CC(=C(C=C3)N4CCOCC4)C(=O)O)OC
InChI=1SC27H30N2O5c1193520(6419)18342510721(1526(25)322)1728228924(23(1622)27(30)31)29111333141229h310151628H11141718H212H3(H3031)
MFCD06664171
ZINC000009892686
ZINC9892686
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