Vitas-M small molecule compound

3-(azepan-1-ylmethyl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-hydroxy-4H-pyran-4-one

Catalog ID
STL311525
SMILES Fc1ccc(cc1)N1CCN(CC1)Cc1coc(c(c1=O)CN1CCCCCC1)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 C23H30FN3O3 MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30FN3O3/c24-19-5-7-20(8-6-19)27-13-11-26(12-14-27)15-18-17-30-23(29)21(22(18)28)16-25-9-3-1-2-4-10-25/h5-8,17,29H,1-4,9-16H2
InChIKey
YXZCDHZGTMNNBT-UHFFFAOYSA-N
Synonyms

3(azepan1ylmethyl)5((4(4fluorophenyl)piperazin1yl)methyl)2hydroxy4Hpyran4one
MFCD22584356
ZINC000101409273

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Available files

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