Vitas-M small molecule compound
[4-(tert-butoxycarbonyl)piperazin-1-yl][1-(carboxymethyl)-6-fluoro-1H-indol-3-yl]acetic acid
Catalog ID
STK929793
SMILES OC(=O)Cn1cc(c2c1cc(F)cc2)C(N1CCN(CC1)C(=O)OC(C)(C)C)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 C21H26FN3O6 MW 435.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26FN3O6/c1-21(2,3)31-20(30)24-8-6-23(7-9-24)18(19(28)29)15-11-25(12-17(26)27)16-10-13(22)4-5-14(15)16/h4-5,10-11,18H,6-9,12H2,1-3H3,(H,26,27)(H,28,29)InChIKey
XBMMKEWWGPGDJR-UHFFFAOYSA-NSynonyms
1214637-41-8(4(tertbutoxycarbonyl)piperazin1yl)(1(carboxymethyl)6fluoro1Hindol3yl)aceticacid
1214637418
2(1(carboxymethyl)6fluoroindol3yl)2(4((2methylpropan2yl)oxycarbonyl)piperazin1yl)aceticacid
2(4(tertbutoxycarbonyl)piperazin1yl)2(1(carboxymethyl)6fluoro1Hindol3yl)aceticacid
CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CN(C3=C2C=CC(=C3)F)CC(=O)O)C(=O)O
InChI=1SC21H26FN3O6c121(23)3120(30)248623(7924)18(19(28)29)151125(1217(26)27)161013(22)4514(15)16h45101118H6912H213H3(H2627)(H2829)
MFCD13755734
ZINC000036353273
ZINC000036353274
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