Vitas-M small molecule compound

octyl 2-amino-1-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

Catalog ID
STK990015
SMILES CCCCCCCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1

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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 C25H28N4O2 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O2/c1-2-3-4-5-6-12-17-31-25(30)21-22-24(28-20-16-11-10-15-19(20)27-22)29(23(21)26)18-13-8-7-9-14-18/h7-11,13-16H,2-6,12,17,26H2,1H3
InChIKey
XOSCLTFUTUCSTL-UHFFFAOYSA-N
Synonyms

CCCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4)N
InChI=1SC25H28N4O2c12345612173125(30)212224(28201611101519(20)2722)29(23(21)26)18138791418h7111316H26121726H21H3
MFCD05702945
octyl2amino1phenyl1Hpyrrolo(23b)quinoxaline3carboxylate
OCTYL2AMINO1PHENYLPYRROLO(32B)QUINOXALINE3CARBOXYLATE
ZINC000097998499
ZINC97998499

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Available files

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