Vitas-M small molecule compound

dimethyl 4-hydroxy-5-[(3-phenylpropyl)amino]tetrahydropyridazine-1,2-dicarboxylate

Catalog ID
STK530445
SMILES COC(=O)N1CC(NCCCc2ccccc2)C(CN1C(=O)OC)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 C17H25N3O5 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O5/c1-24-16(22)19-11-14(15(21)12-20(19)17(23)25-2)18-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,14-15,18,21H,6,9-12H2,1-2H3
InChIKey
LRCGOYJUWYBPGW-UHFFFAOYSA-N
Synonyms

COC(=O)N1CC(C(CN1C(=O)OC)O)NCCCC2=CC=CC=C2
COC(=O)N1CC(NCCCc2ccccc2)C(CN1C(=O)OC)OCl
dimethyl4hydroxy5((3phenylpropyl)amino)tetrahydropyridazine12dicarboxylate
dimethyl4hydroxy5((3phenylpropyl)amino)tetrahydropyridazine12dicarboxylatehydrochloride
DIMETHYL4HYDROXY5(3PHENYLPROPYLAMINO)DIAZINANE12DICARBOXYLATE
InChI=1SC17H25N3O5c12416(22)191114(15(21)1220(19)17(23)252)181069137435813h357814151821H6912H212H3
MFCD01087292
ZINC000004863012
ZINC000004863015

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Available files

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