Vitas-M small molecule compound

3-hydroxy-N-[(2S)-1-{[2-(4-methoxyphenyl)ethyl]amino}-1-oxo-3-phenylpropan-2-yl]quinoxaline-1(2H)-carboxamide

Catalog ID
STK614204
SMILES COc1ccc(cc1)CCNC(=O)[C@@H](NC(=O)N1CC(=Nc2c1cccc2)O)Cc1ccccc1

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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 C27H28N4O4 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4/c1-35-21-13-11-19(12-14-21)15-16-28-26(33)23(17-20-7-3-2-4-8-20)30-27(34)31-18-25(32)29-22-9-5-6-10-24(22)31/h2-14,23H,15-18H2,1H3,(H,28,33)(H,29,32)(H,30,34)/t23-/m0/s1
InChIKey
PRHVHHIEYZAWAY-QHCPKHFHSA-N
Synonyms
1013752-15-2
1013752152
3hydroxyN((2S)1((2(4methoxyphenyl)ethyl)amino)1oxo3phenylpropan2yl)quinoxaline1(2H)carboxamide
COC1=CC=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NC(=O)N3CC(=O)NC4=CC=CC=C43
COc1ccc(cc1)CCNC(=O)(C@@H)(NC(=O)N1CC(=Nc2c1cccc2)O)Cc1ccccc1
InChI=1SC27H28N4O4c13521131119(121421)15162826(33)23(17207324820)3027(34)311825(32)29229561024(22)31h21423H1518H21H3(H2833)(H2932)(H3034)t23m0s1
MFCD18158679
N((2S)1(2(4methoxyphenyl)ethylamino)1oxo3phenylpropan2yl)3oxo24dihydroquinoxaline1carboxamide
ZINC000013551297
ZINC13551297

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Available files

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