Vitas-M small molecule compound
{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}(5-methyl-1H-indol-3-yl)acetic acid
Catalog ID
STK633847
SMILES Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)C(c1c[nH]c2c1cc(C)cc2)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 C28H27F2N3O2 MW 475.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27F2N3O2/c1-18-2-11-25-23(16-18)24(17-31-25)27(28(34)35)33-14-12-32(13-15-33)26(19-3-7-21(29)8-4-19)20-5-9-22(30)10-6-20/h2-11,16-17,26-27,31H,12-15H2,1H3,(H,34,35)InChIKey
GTOZYQMJURGGEF-UHFFFAOYSA-NSynonyms
1040694-06-1(4(bis(4fluorophenyl)methyl)piperazin1yl)(5methyl1Hindol3yl)aceticacid
1040694061
2(4(bis(4fluorophenyl)methyl)piperazin1yl)2(5methyl1Hindol3yl)aceticacid
CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F
Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)C(c1c(nH)c2c1cc(C)cc2)C(=O)O
InChI=1SC28H27F2N3O2c1182112523(1618)24(173125)27(28(34)35)33141232(131533)26(193721(29)8419)205922(30)10620h2111617262731H1215H21H3(H3435)
MFCD12210197
ZINC000020745266
ZINC000020745267
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