Vitas-M small molecule compound

2-amino-1-(4-methoxybenzyl)-N-(4-phenylbutan-2-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK920159
SMILES COc1ccc(cc1)Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(CCc1ccccc1)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 C29H29N5O2 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O2/c1-19(12-13-20-8-4-3-5-9-20)31-29(35)25-26-28(33-24-11-7-6-10-23(24)32-26)34(27(25)30)18-21-14-16-22(36-2)17-15-21/h3-11,14-17,19H,12-13,18,30H2,1-2H3,(H,31,35)
InChIKey
LSCQWTBEPYNRDJ-UHFFFAOYSA-N
Synonyms
843668-71-3
2AMINO1((4METHOXYPHENYL)METHYL)N(4PHENYLBUTAN2YL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2AMINO1(4METHOXYBENZYL)N(1METHYL3PHENYLPROPYL)1HPYRROLO(23B)QUINOXALINE3CARBOXAMIDE
2amino1(4methoxybenzyl)N(4phenylbutan2yl)1Hpyrrolo(23b)quinoxaline3carboxamide
843668713
CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=C(C=C5)OC)N
InChI=1SC29H29N5O2c119(1213208435920)3129(35)252628(332411761023(24)3226)34(27(25)30)1821141622(362)171521h311141719H12131830H212H3(H3135)
MFCD04162791
ZINC000002407668
ZINC000002407669

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Available files

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