Vitas-M small molecule compound

3-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}bicyclo[2.2.2]octane-2-carboxylic acid

Catalog ID
STK480211
SMILES COc1ccccc1N1CCN(CC1)C(=O)C1C2CCC(C1C(=O)O)CC2

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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 C21H28N2O4 MW 372.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O4/c1-27-17-5-3-2-4-16(17)22-10-12-23(13-11-22)20(24)18-14-6-8-15(9-7-14)19(18)21(25)26/h2-5,14-15,18-19H,6-13H2,1H3,(H,25,26)
InChIKey
NADFWDGQWYLOPC-UHFFFAOYSA-N
Synonyms

2(4(2METHOXYPHENYL)PIPERAZINE1CARBONYL)BICYCLO(222)OCTANE3CARBOXYLICACID
3((4(2methoxyphenyl)piperazin1yl)carbonyl)bicyclo(222)octane2carboxylicacid
COC1=CC=CC=C1N2CCN(CC2)C(=O)C3C4CCC(C3C(=O)O)CC4
InChI=1SC21H28N2O4c12717532416(17)22101223(131122)20(24)18146815(9714)19(18)21(25)26h2514151819H613H21H3(H2526)
MFCD06066023
ZINC000006715805
ZINC000006715808

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Available files

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