Vitas-M small molecule compound
2-(azepan-1-ylmethyl)-5-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-4H-pyran-4-one
Catalog ID
STL312375
SMILES O=C(N1CCN(CC1)Cc1ccccc1)COc1coc(cc1=O)CN1CCCCCC1
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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 C25H33N3O4 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O4/c29-23-16-22(18-26-10-6-1-2-7-11-26)31-19-24(23)32-20-25(30)28-14-12-27(13-15-28)17-21-8-4-3-5-9-21/h3-5,8-9,16,19H,1-2,6-7,10-15,17-18,20H2InChIKey
JPZXCPIVQBKKDC-UHFFFAOYSA-NSynonyms
1401540-65-51401540655
2(azepan1ylmethyl)5(2(4benzylpiperazin1yl)2oxoethoxy)4Hpyran4one
2(azepan1ylmethyl)5(2(4benzylpiperazin1yl)2oxoethoxy)pyran4one
C1CCCN(CC1)CC2=CC(=O)C(=CO2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4
InChI=1SC25H33N3O4c29231622(18261061271126)311924(23)322025(30)28141227(131528)17218435921h35891619H12671015171820H2
MFCD22583885
ZINC000079484666
ZINC79484666
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