ChemicalBook CAS DataBase List 1365060-22-5

1365060-22-5

Name	LX-5061
CAS	1365060-22-5
Molecular Formula	C11H9ClN2O2S2
MDL Number	MFCD22572369
Molecular Weight	300.78
MOL File	1365060-22-5.mol

Chemical Properties

storage temp.	Store at -20°C
solubility	Soluble in DMSO
form	Solid
color	White to light yellow
InChI	1S/C11H9ClN2O2S2/c12-10-7(5-1-2-5)8-9(18-10)11(14-4-13-8)17-3-6(15)16/h4-5H,1-3H2,(H,15,16)
InChIKey	LJYRIWUQISYYHA-UHFFFAOYSA-N
SMILES	[s]1c2c(ncnc2SCC(=O)O)c(c1Cl)C3CC3

Safety Data

WGK Germany	WGK 3
Storage Class	11 - Combustible Solids

Hazard Information

Uses

LP-922056 is an orally active, highly potent Notum Pectinacetylesterase inhibitor with EC50s of 21 nM, 55 nM in human and mouse cellular assay, respectively. LP-922056 significantly increases midshaft femur cortical bone thickness in mice and rats[1][2].

Biological Activity

LP-922056 is an orally activepotent and selective NOTUM pectinacetylesterase inhibitor th at activates Wnt signaling. LP-922056 stimulates endocortical bone formation in rodents and in humanized NOTUM mouse line.

in vivo

LP-922056 (compound 44; 3-30 mg/kg; oral gavage; daily; for 25 days) causes an increase in cortical bone thickness at all doses^[1].
? LP-922056 (10 mg/kg; orally) achieves high C_max (129 μM) and AUC (1533 μM?h)^[1].
? LP-922056 (10?mg/kg; daily diet; for 4 weeks) increases cortical bone thickness and strength in midshaft femur, bone mass in the femoral neck and vertebral body cortical shell in Twelve-week-old male mice^[2].

Animal Model:	F1 male hybrid (129xC57) mice at 8.7 weeks of age^[1]
Dosage:	3, 10, 30 mg/kg
Administration:	Oral gavage; daily; for 25 days
Result:	Caused an increase in cortical bone thickness at all doses.

Animal Model:	Mouse^[1]
Dosage:	10 mg/kg (Pharmacokinetic Analysis)
Administration:	Orally
Result:	Achieved high C_max (129 μM) and AUC (1533 μM?h) while has low clearance (0.49 mL/min?kg) and volume of distribution (0.13 L/kg).

storage

Store at -20°C

References

[1] James E Tarver Jr, et al. Stimulation of cortical bone formation with thienopyrimidine based inhibitors of Notum Pectinacetylesterase. Bioorg Med Chem Lett. 2016 Mar 15;26(6):1525-1528. DOI:10.1016/j.bmcl.2016.02.021
[2] Robert Brommage, et al. NOTUM inhibition increases endocortical bone formation and bone strength. Bone Res. 2019 Jan 8;7:2. DOI:10.1038/s41413-018-0038-3

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