Vitas-M small molecule compound
3-{[4-(3-fluorobenzyl)piperazin-1-yl]carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK480210
SMILES Fc1cccc(c1)CN1CCN(CC1)C(=O)C1C2C=CC(C1C(=O)O)C2
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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 C20H23FN2O3 MW 358.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN2O3/c21-16-3-1-2-13(10-16)12-22-6-8-23(9-7-22)19(24)17-14-4-5-15(11-14)18(17)20(25)26/h1-5,10,14-15,17-18H,6-9,11-12H2,(H,25,26)InChIKey
ZYNHHNSCGDFQLP-UHFFFAOYSA-NSynonyms
2(4((3FLUOROPHENYL)METHYL)PIPERAZINE1CARBONYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((4((3FLUOROPHENYL)METHYL)PIPERAZINYL)CARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((4(3fluorobenzyl)piperazin1yl)carbonyl)bicyclo(221)hept5ene2carboxylicacid
C1CN(CCN1CC2=CC(=CC=C2)F)C(=O)C3C4CC(C3C(=O)O)C=C4
InChI=1SC20H23FN2O3c211631213(1016)12226823(9722)19(24)17144515(1114)18(17)20(25)26h151014151718H691112H2(H2526)
MFCD06063778
ZINC000101278706
ZINC000244900243
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