Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-3-{[(4-oxoquinazolin-3(4H)-yl)acetyl]amino}propanoic acid
Catalog ID
STK716927
SMILES COc1cc(ccc1OC)C(CC(=O)O)NC(=O)Cn1cnc2c(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 C21H21N3O6 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O6/c1-29-17-8-7-13(9-18(17)30-2)16(10-20(26)27)23-19(25)11-24-12-22-15-6-4-3-5-14(15)21(24)28/h3-9,12,16H,10-11H2,1-2H3,(H,23,25)(H,26,27)InChIKey
FPJGDKKHSAVZOC-UHFFFAOYSA-NSynonyms
903199-32-63(34dimethoxyphenyl)3(((4oxoquinazolin3(4H)yl)acetyl)amino)propanoicacid
3(34dimethoxyphenyl)3((2(4oxoquinazolin3yl)acetyl)amino)propanoicacid
3(34dimethoxyphenyl)3(2(4oxoquinazolin3(4H)yl)acetamido)propanoicacid
903199326
COC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)CN2C=NC3=CC=CC=C3C2=O)OC
InChI=1SC21H21N3O6c129178713(918(17)302)16(1020(26)27)2319(25)1124122215643514(15)21(24)28h391216H1011H212H3(H2325)(H2627)
MFCD08292184
ZINC000006760548
ZINC000006760549
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