| Identification | Back Directory | [Name]
methyl 4-(2-{[4-(2-{2-[(3r)-adamantan-1-yl]acetamido}acetyl)piperazin-1-yl]methyl}phenoxymethyl)benzoate | [CAS]
1335113-30-8 | [Synonyms]
Methyl 4-[[2-[[4-[2-[[2-(1-adamantyl)acetyl]amino]acetyl]piperazin-1-yl]methyl]phenoxy]methyl]benzoate
methyl 4-(2-{[4-(2-{2-[(3r)-adamantan-1-yl]acetamido}acetyl)piperazin-1-yl]methyl}phenoxymethyl)benzoate
Benzoic acid, 4-[[2-[[4-[2-[(2-tricyclo[3.3.1.13,7]dec-1-ylacetyl)amino]acetyl]-1-piperazinyl]methyl]phenoxy]methyl]-, methyl ester | [Molecular Formula]
C34H43N3O5 | [MDL Number]
MFCD29037822 | [MOL File]
1335113-30-8.mol | [Molecular Weight]
573.72 |
| Chemical Properties | Back Directory | [Boiling point ]
758.4±60.0 °C(Predicted) | [density ]
1.220±0.06 g/cm3(Predicted) | [storage temp. ]
Store at 0-8 °C | [form ]
Solid | [pka]
15.15±0.46(Predicted) | [color ]
White to off-white |
| Hazard Information | Back Directory | [Uses]
EBOV-IN-1 (com 3.47) is an adamantane dipeptide piperazine and an inhibitor of Ebola virus (EBOV). EBOV-IN-1 targets Niemann-Pick C1 (NPC1) and inhibits its binding to the EBOV glycoprotein (GP) that activates and mediates viral penetration into host cells, thereby inhibiting EBOV infection. EBOV-IN-1 inhibits pseudotyped EBOV infection with an IC50 of 13 nM[1]. | [References]
[1] Liu H, et al. Identification of Potent Ebola Virus Entry Inhibitors with Suitable Properties for in Vivo Studies. J Med Chem. 2018 Jul 26;61(14):6293-6307. DOI:10.1021/acs.jmedchem.8b00704 |
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