1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
Synonym(s):1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
- CAS NO.:96969-83-4
- Empirical Formula: C30H26N2O4
- Molecular Weight: 478.54
- MDL number: MFCD00208443
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-05-18 11:31:21
What is 1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone?
Description
Human sirtuin 2 (SIRT2) is a NAD+-
The Uses of 1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
BML-266 is an inhibitor of SIRT2.
Definition
ChEBI: 1,4-bis[2-(4-hydroxyphenyl)ethylamino]anthracene-9,10-dione is an anthraquinone.
What are the applications of Application
BML-266 is A SIRT2 inhibitor
in vitro
in a previou study, the molecular modeling and virtual screening were utilized to identify potential compounds, which were then subjected to experimental tests for their sirt2 inhibitory activity. five of the 15 tested compounds including jfd00244 displayed inhibitory activity toward sirt2, resulting in a hit ratio of 33% in a micromolar level. jfd00244 and another analog of the five compounds yielded in vitro ic(50) values of 56.7 and 74.3 microm, respectively. on the basis of these results, a phenol moiety on the active compounds including jfd00244 was suggested to be critical for sirt2 inhibitory activity. this phenol group, together with a hydrophobic moiety and hydrogen-bonding features, was thus recommended to form an active sirt2 pharmacophore [1].
References
[1] tervo aj, kyrylenko s, niskanen p, salminen a, leppnen j, nyrnen th, jrvinen t, poso a. an in silico approach to discovering novel inhibitors of human sirtuin type 2. j med chem. 2004 dec 2;47(25):6292-8.
Properties of 1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
Boiling point: | 780.2±60.0 °C(Predicted) |
Density | 1.370±0.06 g/cm3(Predicted) |
storage temp. | Room temp |
solubility | DMSO: ≥10mg/mL |
pka | 9.76±0.15(Predicted) |
form | solid |
color | violet |
Safety information for 1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
Signal word | Warning |
Pictogram(s) |
Environment GHS09 |
GHS Hazard Statements |
H400:Hazardous to the aquatic environment, acute hazard |
Precautionary Statement Codes |
P273:Avoid release to the environment. |
Computed Descriptors for 1,4-Bis[(p-hydroxyphenethyl)amino]-anthraquinone
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