Vitas-M small molecule compound
2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl methyl benzene-1,3-dicarboxylate
Catalog ID
STL014267
SMILES COC(=O)c1cccc(c1)C(=O)OCC(=O)N1CCN(CC1)c1ccc(cc1)F
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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 C21H21FN2O5 MW 400.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O5/c1-28-20(26)15-3-2-4-16(13-15)21(27)29-14-19(25)24-11-9-23(10-12-24)18-7-5-17(22)6-8-18/h2-8,13H,9-12,14H2,1H3InChIKey
RHCMPYVYZOPYDS-UHFFFAOYSA-NSynonyms
2(4(4fluorophenyl)piperazin1yl)2oxoethylmethylbenzene13dicarboxylate
3O(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)1Omethylbenzene13dicarboxylate
COC(=O)C1=CC(=CC=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F
InChI=1SC21H21FN2O5c12820(26)1532416(1315)21(27)291419(25)2411923(101224)187517(22)6818h2813H91214H21H3
MFCD18186414
ZINC000051357040
ZINC51357040
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