Vitas-M small molecule compound

methyl N-[(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)acetyl]-beta-alaninate

Catalog ID
STL496332
SMILES COC(=O)CCNC(=O)CN1C(=O)c2ccccc2N2C1c1ccc(c(c1C2=O)OC)OC

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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 C23H23N3O7 MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O7/c1-31-16-9-8-14-19(20(16)33-3)23(30)26-15-7-5-4-6-13(15)22(29)25(21(14)26)12-17(27)24-11-10-18(28)32-2/h4-9,21H,10-12H2,1-3H3,(H,24,27)
InChIKey
ZPTDCODQNSFGEY-UHFFFAOYSA-N
Synonyms
1630851-11-4
1630851114
91638366
InChI=1SC23H23N3O7c13116981419(20(16)333)23(30)2615754613(15)22(29)25(21(14)26)1217(27)24111018(28)322h4921H1012H213H3(H2427)
methyl3((2(910dimethoxy511dioxo6aHisoindolo(21a)quinazolin6yl)acetyl)amino)propanoate
methyl3(2(910dimethoxy511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)acetamido)propanoate
methylN((910dimethoxy511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)acetyl)betaalaninate
MFCD28349964
ZINC000217885825
ZINC000217885906

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Available files

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