Vitas-M small molecule compound

{5-[(2-methylpropanoyl)amino]-1H-indol-3-yl}[4-(pyridin-2-yl)piperazin-1-yl]acetic acid

Catalog ID
STK654348
SMILES OC(=O)C(c1c[nH]c2c1cc(cc2)NC(=O)C(C)C)N1CCN(CC1)c1ccccn1

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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 C23H27N5O3 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3/c1-15(2)22(29)26-16-6-7-19-17(13-16)18(14-25-19)21(23(30)31)28-11-9-27(10-12-28)20-5-3-4-8-24-20/h3-8,13-15,21,25H,9-12H2,1-2H3,(H,26,29)(H,30,31)
InChIKey
AOOMQJJGEZWGER-UHFFFAOYSA-N
Synonyms
1214718-26-9
(5((2methylpropanoyl)amino)1Hindol3yl)(4(pyridin2yl)piperazin1yl)aceticacid
1214718269
2(5(2methylpropanoylamino)1Hindol3yl)2(4pyridin2ylpiperazin1yl)aceticacid
2(5isobutyramido1Hindol3yl)2(4(pyridin2yl)piperazin1yl)aceticacid
CC(C)C(=O)NC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C4=CC=CC=N4
InChI=1SC23H27N5O3c115(2)22(29)2616671917(1316)18(142519)21(23(30)31)2811927(101228)2053482420h3813152125H912H212H3(H2629)(H3031)
MFCD13760922
OC(=O)C(c1c(nH)c2c1cc(cc2)NC(=O)C(C)C)N1CCN(CC1)c1ccccn1
ZINC000096736400
ZINC000096736401

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Available files

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