Vitas-M small molecule compound
{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}(5-methoxy-1H-indol-3-yl)acetic acid
Catalog ID
STK644080
SMILES COc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)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 C28H27F2N3O3 MW 491.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27F2N3O3/c1-36-22-10-11-25-23(16-22)24(17-31-25)27(28(34)35)33-14-12-32(13-15-33)26(18-2-6-20(29)7-3-18)19-4-8-21(30)9-5-19/h2-11,16-17,26-27,31H,12-15H2,1H3,(H,34,35)InChIKey
COQKLIUUFRBLDO-UHFFFAOYSA-NSynonyms
1040714-99-5(4(bis(4fluorophenyl)methyl)piperazin1yl)(5methoxy1Hindol3yl)aceticacid
1040714995
2(4(bis(4fluorophenyl)methyl)piperazin1yl)2(5methoxy1Hindol3yl)aceticacid
COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F
COc1ccc2c(c1)c(c(nH)2)C(N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)C(=O)O
InChI=1SC28H27F2N3O3c1362210112523(1622)24(173125)27(28(34)35)33141232(131533)26(182620(29)7318)194821(30)9519h2111617262731H1215H21H3(H3435)
MFCD12208729
ZINC000020735155
ZINC000020735159
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