| Chemical Properties | Back Directory | [Boiling point ]
389.4±42.0 °C(Predicted) | [density ]
1.186±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted) | [solubility ]
Ethanol: 10 mg/ml | [form ]
Solid | [pka]
13.14±0.46(Predicted) | [color ]
White to off-white | [InChI]
InChI=1S/C17H18F2N2O/c1-21(2)16(12-6-4-3-5-7-12)11-20-17(22)13-8-14(18)10-15(19)9-13/h3-10,16H,11H2,1-2H3,(H,20,22)/t16-/m0/s1 | [InChIKey]
SDNDFXUSMLLOMH-INIZCTEOSA-N | [SMILES]
C(NC[C@H](N(C)C)C1=CC=CC=C1)(=O)C1=CC(F)=CC(F)=C1 |
| Hazard Information | Back Directory | [Uses]
(R)-HTS-3 is an lysophosphatidylcholine acyltransferase 3 (LPCAT3) inhibitor, with an IC50 of 0.09 μM. (R)-HTS-3 suppresses the C20:4 content of PE, PC, and PS, while promoting a correspondingelevation in C22:4 phospholipids and a paradoxical increase in C20:4 phosphatidylinositol (PI) lipids[1]. | [References]
[1] Alex Reed, et al. LPCAT3 Inhibitors Remodel the Polyunsaturated Phospholipid Content of Human Cells and Protect from Ferroptosis. ACS Chem Biol. 2022 Jun 17;17(6):1607-1618. DOI:10.1021/acschembio.2c00317 |
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