Vitas-M small molecule compound

propyl 5-{[(3-bromo-4-methoxyphenyl)carbonyl]amino}-2-(morpholin-4-yl)benzoate

Catalog ID
STK219895
SMILES CCCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)Br)OC

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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 C22H25BrN2O5 MW 477.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN2O5/c1-3-10-30-22(27)17-14-16(5-6-19(17)25-8-11-29-12-9-25)24-21(26)15-4-7-20(28-2)18(23)13-15/h4-7,13-14H,3,8-12H2,1-2H3,(H,24,26)
InChIKey
ITVHJQZZAVDYMA-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)OC)Br)N3CCOCC3
InChI=1SC22H25BrN2O5c13103022(27)171416(5619(17)258112912925)2421(26)154720(282)18(23)1315h471314H3812H212H3(H2426)
MFCD06665384
PROPYL5(((3BROMO4METHOXYPHENYL)CARBONYL)AMINO)2(MORPHOLIN4YL)BENZOATE
propyl5((3bromo4methoxybenzoyl)amino)2morpholin4ylbenzoate
ZINC000013838375
ZINC13838375

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Available files

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