Vitas-M small molecule compound
(2Z)-2-(2-fluorobenzylidene)-6-hydroxy-4-methyl-5,7-bis(piperidin-1-ylmethyl)-1-benzofuran-3(2H)-one
Catalog ID
STL034476
SMILES O=C1/C(=C/c2ccccc2F)/Oc2c1c(C)c(c(c2CN1CCCCC1)O)CN1CCCCC1
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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 C28H33FN2O3 MW 464.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33FN2O3/c1-19-21(17-30-12-6-2-7-13-30)26(32)22(18-31-14-8-3-9-15-31)28-25(19)27(33)24(34-28)16-20-10-4-5-11-23(20)29/h4-5,10-11,16,32H,2-3,6-9,12-15,17-18H2,1H3/b24-16-InChIKey
NCNRLVCQPMHCRP-JLPGSUDCSA-NSynonyms
(2Z)2((2fluorophenyl)methylidene)6hydroxy4methyl57bis(piperidin1ylmethyl)1benzofuran3one
(2Z)2(2fluorobenzylidene)6hydroxy4methyl57bis(piperidin1ylmethyl)1benzofuran3(2H)one
57BIS(PIPERIDYLMETHYL)2((2FLUOROPHENYL)METHYLENE)6HYDROXY4METHYLBENZO(B)FURAN3ONE
CC1=C2C(=C(C(=C1CN3CCCCC3)O)CN4CCCCC4)OC(=CC5=CC=CC=C5F)C2=O
InChI=1SC28H33FN2O3c11921(1730126271330)26(32)22(1831148391531)2825(19)27(33)24(3428)162010451123(20)29h4510111632H236912151718H21H3b2416
MFCD10041307
O=C1C(=Cc2ccccc2F)Oc2c1c(C)c(c(c2CN1CCCCC1)O)CN1CCCCC1
ZINC000011865253
ZINC11865253
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