Vitas-M small molecule compound
[1-(carboxymethyl)-6-fluoro-1H-indol-3-yl]{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}acetic acid
Catalog ID
STK657613
SMILES OC(=O)Cn1cc(c2c1cc(F)cc2)C(N1CCN(CC1)CC(=O)N1CCOCC1)C(=O)O
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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 C22H27FN4O6 MW 462.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27FN4O6/c23-15-1-2-16-17(12-27(14-20(29)30)18(16)11-15)21(22(31)32)26-5-3-24(4-6-26)13-19(28)25-7-9-33-10-8-25/h1-2,11-12,21H,3-10,13-14H2,(H,29,30)(H,31,32)InChIKey
AUHXPYKBRAXYBX-UHFFFAOYSA-NSynonyms
1214666-71-3(1(carboxymethyl)6fluoro1Hindol3yl)(4(2(morpholin4yl)2oxoethyl)piperazin1yl)aceticacid
1214666713
2(1(carboxymethyl)6fluoro1Hindol3yl)2(4(2morpholino2oxoethyl)piperazin1yl)aceticacid
2(1(carboxymethyl)6fluoroindol3yl)2(4(2morpholin4yl2oxoethyl)piperazin1yl)aceticacid
C1CN(CCN1CC(=O)N2CCOCC2)C(C3=CN(C4=C3C=CC(=C4)F)CC(=O)O)C(=O)O
InChI=1SC22H27FN4O6c2315121617(1227(1420(29)30)18(16)1115)21(22(31)32)265324(4626)1319(28)25793310825h12111221H3101314H2(H2930)(H3132)
MFCD13759554
ZINC000036360370
ZINC000036360371
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