Vitas-M small molecule compound

[1-(carboxymethyl)-5-methoxy-1H-indol-3-yl][4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]acetic acid

Catalog ID
STK657813
SMILES COc1ccc2c(c1)c(cn2CC(=O)O)C(N1CCC(CC1)c1noc2c1ccc(c2)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 C25H24FN3O6 MW 481.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3O6/c1-34-16-3-5-20-18(11-16)19(12-29(20)13-22(30)31)24(25(32)33)28-8-6-14(7-9-28)23-17-4-2-15(26)10-21(17)35-27-23/h2-5,10-12,14,24H,6-9,13H2,1H3,(H,30,31)(H,32,33)
InChIKey
FGPVGQUQPAJVOO-UHFFFAOYSA-N
Synonyms
1214043-45-4
(1(carboxymethyl)5methoxy1Hindol3yl)(4(6fluoro12benzoxazol3yl)piperidin1yl)aceticacid
1214043454
2(1(carboxymethyl)5methoxy1Hindol3yl)2(4(6fluorobenzo(d)isoxazol3yl)piperidin1yl)aceticacid
2(1(carboxymethyl)5methoxyindol3yl)2(4(6fluoro12benzoxazol3yl)piperidin1yl)aceticacid
COC1=CC2=C(C=C1)N(C=C2C(C(=O)O)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)CC(=O)O
InChI=1SC25H24FN3O6c13416352018(1116)19(1229(20)1322(30)31)24(25(32)33)288614(7928)23174215(26)1021(17)352723h2510121424H6913H21H3(H3031)(H3233)
MFCD13759504
ZINC000036360306
ZINC000036360307

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.