Inhibitor Report for: TFAH-tacrine-ferulic-acid-hybrid-10n
| TFAH-tacrine-ferulic-acid-hybrid-10n | Type (6) |
|---|
| Other_Name | (E)-3-(hydroxy-3-methoxyphenyl)-N-{8[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl}-N-[2-(naphthalen-2-ylamino)2-oxoethyl]acrylamide |
| | CHEMBL4552675 |
| | BDBM50510850 |
| Chemical_Nomenclature | (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[8-[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl]-N-[2-(naphthalen-2-ylamino)-2-oxoethyl]prop-2-enamide |
| Formula | C44H50N4O5 |
| MW | 714.9 |
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| Paper | Benchekroun_2015_ChemMedChem_10_523 |
| Comment | BCHE IC50=68.2 nM |
| CID | 132281442 |
| Family | BCHE |
| InChIKey | CIMNCRAYKQYYMB-HKOYGPOVSA-N |
| CanonicalSMILES | COC1=CC2=C(C=C1)N=C3CCCCC3=C2NCCCCCCCCN(CC(=O)NC4=CC5=CC=CC=C5C=C4)C(=O)C=CC6=CC(=C(C=C6)O)OC |
| InChI | InChI=1S/C44H50N4O5/c1-52-35-21-22-39-37(29-35)44(36-15-9-10-16-38(36)47-39)45-25-11-5-3-4-6-12-26-48(43(51)24-18-31-17-23-40(49)41(27-31)53-2)30-42(50)46-34-20-19-32-13-7-8-14-33(32)28-34/h7-8,13-14,17-24,27-29,49H,3-6,9-12,15-16,25-26,30H2,1-2H3,(H,45,47)(H,46,50)/b24-18+ |
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