Vitas-M small molecule compound

methyl 7-(4-hydroxy-3-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate

Catalog ID
STK788218
SMILES COC(=O)C1=C(C)Nc2n(C1c1ccc(c(c1)OC)O)nnn2

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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 C14H15N5O4 MW 317.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N5O4/c1-7-11(13(21)23-3)12(19-14(15-7)16-17-18-19)8-4-5-9(20)10(6-8)22-2/h4-6,12,20H,1-3H3,(H,15,16,18)
InChIKey
GEOAQYUCCPPSKD-UHFFFAOYSA-N
Synonyms

CC1=C(C(N2C(=N1)N=NN2)C3=CC(=C(C=C3)O)OC)C(=O)OC
InChI=1SC14H15N5O4c1711(13(21)233)12(1914(157)16171819)8459(20)10(68)222h461220H13H3(H151618)
METHYL7(4HYDROXY3METHOXYPHENYL)5METHYL17DIHYDROTETRAZOLO(15A)PYRIMIDINE6CARBOXYLATE
methyl7(4hydroxy3methoxyphenyl)5methyl47dihydrotetrazolo(15a)pyrimidine6carboxylate
MFCD02130014
ZINC000005016115
ZINC000005016117

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Available files

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