Vitas-M small molecule compound

methyl 5-({3-[(4-chlorobenzyl)oxy]benzyl}amino)-2-(morpholin-4-yl)benzoate

Catalog ID
STK195092
SMILES COC(=O)c1cc(NCc2cccc(c2)OCc2ccc(cc2)Cl)ccc1N1CCOCC1

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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 C26H27ClN2O4 MW 466.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN2O4/c1-31-26(30)24-16-22(9-10-25(24)29-11-13-32-14-12-29)28-17-20-3-2-4-23(15-20)33-18-19-5-7-21(27)8-6-19/h2-10,15-16,28H,11-14,17-18H2,1H3
InChIKey
YTYJKHSJCMLUBQ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C=CC(=C1)NCC2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl)N4CCOCC4
InChI=1SC26H27ClN2O4c13126(30)241622(91025(24)29111332141229)28172032423(1520)3318195721(27)8619h210151628H11141718H21H3
METHYL5((3((4CHLOROBENZYL)OXY)BENZYL)AMINO)2(MORPHOLIN4YL)BENZOATE
METHYL5((3((4CHLOROPHENYL)METHOXY)PHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOATE
MFCD06665556
ZINC000009933557
ZINC09933557
ZINC9933557

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Available files

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