Vitas-M small molecule compound

[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]{5-[(phenylcarbonyl)amino]-1H-indol-3-yl}acetic acid

Catalog ID
STK658031
SMILES CC(=C)CN1CCN(CC1)C(c1c[nH]c2c1cc(cc2)NC(=O)c1ccccc1)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 C25H28N4O3 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3/c1-17(2)16-28-10-12-29(13-11-28)23(25(31)32)21-15-26-22-9-8-19(14-20(21)22)27-24(30)18-6-4-3-5-7-18/h3-9,14-15,23,26H,1,10-13,16H2,2H3,(H,27,30)(H,31,32)
InChIKey
UJBHMEZMEGQNMI-UHFFFAOYSA-N
Synonyms
1144453-73-5
(4(2methylprop2en1yl)piperazin1yl)(5((phenylcarbonyl)amino)1Hindol3yl)aceticacid
1144453735
2(5benzamido1Hindol3yl)2(4(2methylallyl)piperazin1yl)aceticacid
2(5benzamido1Hindol3yl)2(4(2methylprop2enyl)piperazin1yl)aceticacid
CC(=C)CN1CCN(CC1)C(c1c(nH)c2c1cc(cc2)NC(=O)c1ccccc1)C(=O)O
CC(=C)CN1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O
InChI=1SC25H28N4O3c117(2)1628101229(131128)23(25(31)32)211526229819(1420(21)22)2724(30)186435718h3914152326H1101316H22H3(H2730)(H3132)
MFCD12210806
ZINC000031817386
ZINC000031817391

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Available files

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