Vitas-M small molecule compound

methyl N-[3-(4-oxoquinazolin-3(4H)-yl)propanoyl]-N-phenyl-beta-alaninate

Catalog ID
STK611311
SMILES COC(=O)CCN(c1ccccc1)C(=O)CCn1cnc2c(c1=O)cccc2

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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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-28-20(26)12-14-24(16-7-3-2-4-8-16)19(25)11-13-23-15-22-18-10-6-5-9-17(18)21(23)27/h2-10,15H,11-14H2,1H3
InChIKey
ZKZPBBINZDXDFR-UHFFFAOYSA-N
Synonyms
919735-70-9
919735709
COC(=O)CCN(C1=CC=CC=C1)C(=O)CCN2C=NC3=CC=CC=C3C2=O
InChI=1SC21H21N3O4c12820(26)121424(167324816)19(25)1113231522181065917(18)21(23)27h21015H1114H21H3
methyl3(3(4oxoquinazolin3(4H)yl)Nphenylpropanamido)propanoate
methyl3(N(3(4oxoquinazolin3yl)propanoyl)anilino)propanoate
methylN(3(4oxoquinazolin3(4H)yl)propanoyl)Nphenylbetaalaninate
MFCD08749038
ZINC000013628762
ZINC13628762

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Available files

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