Vitas-M small molecule compound

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

Catalog ID
STL533888
SMILES CCC(C(C(=O)NC(C(=O)O)C(C)C)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 C23H34N4O5 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N4O5/c1-7-14(6)18(20(28)25-17(12(2)3)22(30)31)26-23(32)27-16-11-9-8-10-15(16)24-21(29)19(27)13(4)5/h8-14,17-19H,7H2,1-6H3,(H,24,29)(H,25,28)(H,26,32)(H,30,31)
InChIKey
VUXYGWVIHPLBTM-UHFFFAOYSA-N
Synonyms

3methyl2((3methyl2((3oxo2propan2yl24dihydroquinoxaline1carbonyl)amino)pentanoyl)amino)butanoicacid
44667447
InChI=1SC23H34N4O5c1714(6)18(20(28)2517(12(2)3)22(30)31)2623(32)271611981015(16)2421(29)19(27)13(4)5h8141719H7H216H3(H2429)(H2528)(H2632)(H3031)
MFCD08730712
N((3hydroxy2(propan2yl)quinoxalin1(2H)yl)carbonyl)isoleucylvaline
ZINC000008878268
ZINC000253488036

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Available files

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