Vitas-M small molecule compound

methyl 3-(4-bromophenyl)-5-(4-methylphenyl)-2-(morpholin-4-ylcarbonyl)-5-oxo-4-phenylpentanoate

Catalog ID
STK687361
SMILES COC(=O)C(C(C(C(=O)c1ccc(cc1)C)c1ccccc1)c1ccc(cc1)Br)C(=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 C30H30BrNO5 MW 564.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30BrNO5/c1-20-8-10-23(11-9-20)28(33)26(21-6-4-3-5-7-21)25(22-12-14-24(31)15-13-22)27(30(35)36-2)29(34)32-16-18-37-19-17-32/h3-15,25-27H,16-19H2,1-2H3
InChIKey
IPKQTAMTJRTCJH-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)C(C3=CC=C(C=C3)Br)C(C(=O)N4CCOCC4)C(=O)OC
InChI=1SC30H30BrNO5c12081023(11920)28(33)26(216435721)25(22121424(31)151322)27(30(35)362)29(34)32161837191732h3152527H1619H212H3
methyl3(4bromophenyl)5(4methylphenyl)2(morpholin4ylcarbonyl)5oxo4phenylpentanoate
METHYL3(4BROMOPHENYL)5(4METHYLPHENYL)2(MORPHOLINE4CARBONYL)5OXO4PHENYLPENTANOATE
MFCD06618464
ZINC000098008244
ZINC000098008247

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Available files

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