Vitas-M small molecule compound

methyl 5-{[(4-bromophenoxy)acetyl]amino}-2-(morpholin-4-yl)benzoate

Catalog ID
STK183476
SMILES COC(=O)c1cc(ccc1N1CCOCC1)NC(=O)COc1ccc(cc1)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 C20H21BrN2O5 MW 449.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O5/c1-26-20(25)17-12-15(4-7-18(17)23-8-10-27-11-9-23)22-19(24)13-28-16-5-2-14(21)3-6-16/h2-7,12H,8-11,13H2,1H3,(H,22,24)
InChIKey
JKMHMJBSGBWTDA-UHFFFAOYSA-N
Synonyms
766528-54-5
766528545
COC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Br)N3CCOCC3
InChI=1SC20H21BrN2O5c12620(25)171215(4718(17)238102711923)2219(24)1328165214(21)3616h2712H81113H21H3(H2224)
METHYL5(((4BROMOPHENOXY)ACETYL)AMINO)2(MORPHOLIN4YL)BENZOATE
methyl5((2(4bromophenoxy)acetyl)amino)2morpholin4ylbenzoate
methyl5(2(4bromophenoxy)acetamido)2morpholinobenzoate
MFCD06664365
ZINC000009906139
ZINC09906139
ZINC9906139

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Available files

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