Vitas-M small molecule compound

3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylic acid

Catalog ID
STK880301
SMILES OC(=O)c1ccc2c(c1)[nH]c(=O)n(c2=O)Cc1ccc2c(c1)OCO2

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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 C17H12N2O6 MW 340.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O6/c20-15-11-3-2-10(16(21)22)6-12(11)18-17(23)19(15)7-9-1-4-13-14(5-9)25-8-24-13/h1-6H,7-8H2,(H,18,23)(H,21,22)
InChIKey
YDFWNWWYTYVKQJ-UHFFFAOYSA-N
Synonyms
1223886-46-1
1223886461
3(13benzodioxol5ylmethyl)24dioxo1234tetrahydroquinazoline7carboxylicacid
3(13benzodioxol5ylmethyl)24dioxo1Hquinazoline7carboxylicacid
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=C(C=C4)C(=O)O)NC3=O
InChI=1SC17H12N2O6c2015113210(16(21)22)612(11)1817(23)19(15)79141314(59)2582413h16H78H2(H1823)(H2122)
MFCD14703502
OC(=O)c1ccc2c(c1)(nH)c(=O)n(c2=O)Cc1ccc2c(c1)OCO2
ZINC000040478859
ZINC40478859

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Available files

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