Vitas-M small molecule compound

methyl N-[(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)acetyl]-beta-alaninate

Catalog ID
STL566380
SMILES COC(=O)CCNC(=O)CN1C(=O)c2ccccc2N2C1c1ccccc1C2=O

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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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-29-18(26)10-11-22-17(25)12-23-19-13-6-2-3-7-14(13)21(28)24(19)16-9-5-4-8-15(16)20(23)27/h2-9,19H,10-12H2,1H3,(H,22,25)
InChIKey
OGTBCSFPKOJTQQ-UHFFFAOYSA-N
Synonyms

127255146
InChI=1SC21H19N3O5c12918(26)10112217(25)12231913623714(13)21(28)24(19)16954815(16)20(23)27h2919H1012H21H3(H2225)
methyl3((2(511dioxo6aHisoindolo(21a)quinazolin6yl)acetyl)amino)propanoate
methyl3(2(511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)acetamido)propanoate
methylN((511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)acetyl)betaalaninate
MFCD32651898
ZINC000604419649
ZINC000604419656

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Available files

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