Vitas-M small molecule compound

N-{[3-hydroxy-2-(propan-2-yl)quinoxalin-1(2H)-yl]carbonyl}isoleucine

Catalog ID
STL533823
SMILES CCC(C(C(=O)O)NC(=O)N1C(C(C)C)C(=Nc2c1cccc2)O)C

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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 C18H25N3O4 MW 347.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O4/c1-5-11(4)14(17(23)24)20-18(25)21-13-9-7-6-8-12(13)19-16(22)15(21)10(2)3/h6-11,14-15H,5H2,1-4H3,(H,19,22)(H,20,25)(H,23,24)
InChIKey
NPVHAHSXDFHQIN-UHFFFAOYSA-N
Synonyms

3methyl2((3oxo2propan2yl24dihydroquinoxaline1carbonyl)amino)pentanoicacid
44667368
InChI=1SC18H25N3O4c1511(4)14(17(23)24)2018(25)2113976812(13)1916(22)15(21)10(2)3h6111415H5H214H3(H1922)(H2025)(H2324)
MFCD08730075
N((3hydroxy2(propan2yl)quinoxalin1(2H)yl)carbonyl)isoleucine
ZINC000009164623
ZINC000253487660

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Available files

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