Vitas-M small molecule compound
2-(azepan-1-ylmethyl)-5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy}-4H-pyran-4-one
Catalog ID
STL249438
SMILES O=C(N1CCN(CC1)c1ccc(cc1)F)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 C24H30FN3O4 MW 443.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30FN3O4/c25-19-5-7-20(8-6-19)27-11-13-28(14-12-27)24(30)18-32-23-17-31-21(15-22(23)29)16-26-9-3-1-2-4-10-26/h5-8,15,17H,1-4,9-14,16,18H2InChIKey
IDEUZNWOMQDUOO-UHFFFAOYSA-NSynonyms
1374536-77-21374536772
2(azepan1ylmethyl)5(2(4(4fluorophenyl)piperazin1yl)2oxoethoxy)4Hpyran4one
2(azepan1ylmethyl)5(2(4(4fluorophenyl)piperazin1yl)2oxoethoxy)pyran4one
C1CCCN(CC1)CC2=CC(=O)C(=CO2)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC24H30FN3O4c25195720(8619)27111328(141227)24(30)183223173121(1522(23)29)1626931241026h581517H149141618H2
MFCD22202470
ZINC000072403781
ZINC72403781
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