Vitas-M small molecule compound

4-({[2-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoyl]oxy}acetyl)phenyl 4-methylbenzoate

Catalog ID
STK257712
SMILES Cc1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)COC(=O)C(N1C(=O)C2C(C1=O)C1CC2C(C1Br)Br)Cc1ccccc1

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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 C34H29Br2NO7 MW 723.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29Br2NO7/c1-18-7-9-21(10-8-18)33(41)44-22-13-11-20(12-14-22)26(38)17-43-34(42)25(15-19-5-3-2-4-6-19)37-31(39)27-23-16-24(28(27)32(37)40)30(36)29(23)35/h2-14,23-25,27-30H,15-17H2,1H3
InChIKey
HXOUIALPLJVRQN-UHFFFAOYSA-N
Synonyms

4(((2(56DIBROMO13DIOXOOCTAHYDRO2H47METHANOISOINDOL2YL)3PHENYLPROPANOYL)OXY)ACETYL)PHENYL4METHYLBENZOATE
CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C(CC3=CC=CC=C3)N4C(=O)C5C6CC(C5C4=O)C(C6Br)Br
InChI=1SC34H29Br2NO7c1187921(10818)33(41)4422131120(121422)26(38)174334(42)25(15195324619)3731(39)27231624(28(27)32(37)40)30(36)29(23)35h21423252730H1517H21H3
MFCD03900830
ZINC000239309898
ZINC000239309901

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Available files

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