Vitas-M small molecule compound

methyl 5-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-3-hydroxy-5H-pyrazolo[4,3-c]pyridine-7-carboxylate

Catalog ID
STL493239
SMILES COC(=O)c1cn(CC2COc3c(O2)cccc3)cc2c1nnc2O

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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 C17H15N3O5 MW 341.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5/c1-23-17(22)12-8-20(7-11-15(12)18-19-16(11)21)6-10-9-24-13-4-2-3-5-14(13)25-10/h2-5,7-8,10H,6,9H2,1H3,(H,19,21)
InChIKey
RAALMAFAPJZSBG-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C2C1=NNC2=O)CC3COC4=CC=CC=C4O3
InChI=1SC17H15N3O5c12317(22)12820(71115(12)181916(11)21)61092413423514(13)2510h257810H69H21H3(H1921)
methyl5(23dihydro14benzodioxin2ylmethyl)3hydroxy5Hpyrazolo(43c)pyridine7carboxylate
methyl5(23dihydro14benzodioxin3ylmethyl)3oxo2Hpyrazolo(43c)pyridine7carboxylate
MFCD30715656
ZINC000253412442
ZINC000253412443

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Available files

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