LOC14 is a potent protein disulfide isomerase (PDI) inhibitor with an EC50 value of 500 nM and a Kd value of 62 nM.

 

Brand: BCM

 

Target: PDI:500 nM(EC50)

 

In Vitro: LOC14-induced oxidation of PDI has a neuroprotective effect not only in cell culture, but also in corticostriatal brain slice cultures.

 

In Vivo: LOC14 showed high stability in liver microsomes and blood plasma, was tolerated at a high dose of 20 mg/kg in mice, and penetrated the BBB in vivo.

 

Boiling Point: 528.5±60.0 °C(Predicted)

 

pKa: 6.16±0.10(Predicted)

 

Solubility: Soluble in DMSO; Soluble in Ethanol. Insoluble in Water.

 

GHS: GHS07

 

Isomeric SMILES: C1CC1C(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4S3  

 

InChIKey: YVBSNHLFRIVWFQ-UHFFFAOYSA-N  

 

InChI: InChI=1S/C16H19N3O2S/c20-15(12-5-6-12)18-9-7-17(8-10-18)11-19-16(21)13-3-1-2-4-14(13)22-19/h1-4,12H,5-11H2

 

Attribute
[Chem Name]	2-[[4-(cyclopropanecarbonyl)piperazin-1-yl]methyl]-1,2-benzothiazol-3-one
[Synonym]	LOC14
[CAS No.]	877963-94-5
[MDL No.]	MFCD07849042
[Formula]	C16H19N3O2S
[Molecular]	317.41
[Form]	A crystalline solid
[Storage]	Sealed in dry, 2-8°C

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