Vitas-M small molecule compound
[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl](1H-indol-3-yl)acetic acid
Catalog ID
STL238878
SMILES OC(=O)C(c1c[nH]c2c1cccc2)N1CCC(CC1)c1noc2c1ccc(c2)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 C22H20FN3O3 MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3O3/c23-14-5-6-16-19(11-14)29-25-20(16)13-7-9-26(10-8-13)21(22(27)28)17-12-24-18-4-2-1-3-15(17)18/h1-6,11-13,21,24H,7-10H2,(H,27,28)InChIKey
BRUHGNQEYQZLNX-UHFFFAOYSA-NSynonyms
1081139-51-6(4(6fluoro12benzoxazol3yl)piperidin1yl)(1Hindol3yl)aceticacid
1081139516
2(4(6fluoro12benzoxazol3yl)piperidin1yl)2(1Hindol3yl)aceticacid
2(4(6fluorobenzo(d)isoxazol3yl)piperidin1yl)2(1Hindol3yl)aceticacid
C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)C(C4=CNC5=CC=CC=C54)C(=O)O
InChI=1SC22H20FN3O3c2314561619(1114)292520(16)137926(10813)21(22(27)28)17122418421315(17)18h1611132124H710H2(H2728)
MFCD12208763
OC(=O)C(c1c(nH)c2c1cccc2)N1CCC(CC1)c1noc2c1ccc(c2)F
ZINC000020735348
ZINC000020735351
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