Vitas-M small molecule compound
7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Catalog ID
STK407921
SMILES COc1cc(cc(c1O)Br)C1C=C(Nc2n1ncn2)C(=O)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 C13H11BrN4O4 MW 367.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN4O4/c1-22-10-3-6(2-7(14)11(10)19)9-4-8(12(20)21)17-13-15-5-16-18(9)13/h2-5,9,19H,1H3,(H,20,21)(H,15,16,17)InChIKey
IZCQFBJCYHBBGM-UHFFFAOYSA-NSynonyms
7(3bromo4hydroxy5methoxyphenyl)17dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
7(3bromo4hydroxy5methoxyphenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
COC1=C(C(=CC(=C1)C2C=C(N=C3N2NC=N3)C(=O)O)Br)O
InChI=1SC13H11BrN4O4c1221036(27(14)11(10)19)948(12(20)21)17131551618(9)13h25919H1H3(H2021)(H151617)
MFCD11696178
ZINC000101675418
ZINC000101675420
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