| Identification | Back Directory | [Name]
vanin-1 inhibitor | [CAS]
2173134-00-2 | [Synonyms]
VUN34002
vanin-1 inhibitor
Vanin-1 inhibitor 1
VUN34002(vanin-1 inhibitor)
8-Oxa-2-azaspiro[4.5]dec-2-yl[2-[(2-pyrazinylmethyl)amino]-5-pyrimidinyl]methanone
Methanone, 8-oxa-2-azaspiro[4.5]dec-2-yl[2-[(2-pyrazinylmethyl)amino]-5-pyrimidinyl]- | [Molecular Formula]
C18H22N6O2 | [MDL Number]
MFCD32201155 | [MOL File]
2173134-00-2.mol | [Molecular Weight]
354.41 |
| Chemical Properties | Back Directory | [Boiling point ]
617.9±65.0 °C(Predicted) | [density ]
1.34±0.1 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMSO: 125 mg/mL (352.70 mM) | [form ]
Solid | [pka]
1.77±0.10(Predicted) | [color ]
White to off-white | [InChI]
1S/C18H22N6O2/c25-16(24-6-1-18(13-24)2-7-26-8-3-18)14-9-21-17(22-10-14)23-12-15-11-19-4-5-20-15/h4-5,9-11H,1-3,6-8,12-13H2,(H,21,22,23) | [InChIKey]
VGRLXWFIXGZRMS-UHFFFAOYSA-N | [SMILES]
O=C(C1=CN=C(N=C1)NCC2=CN=CC=N2)N3CCC4(C3)CCOCC4 |
| Hazard Information | Back Directory | [Uses]
PFI-653 (Vanin-1-IN-1, compound 3) is a vanin-1 inhibitor that binds to plasma vanin-1 from mouse, rat, dog, and human. Vanin-1 is a cell surface-associated inositol (GPi) -anchored protein that plays important roles in metabolism and inflammation. PFI-653 inhibits vanin-1 from different species with IC50s of 6.85 nM (human recombinant plasma vanin-1), 9.0 nM (human plasma vanin-1), 24.5 nM (mouse recombinant vanin-1), and 53.4 nM (mouse plasma vanin-1)[1][2]. | [Biological Activity]
PFI-653 is a cell permeablepotentand selective inhibitor of Vanin-1 (Vascular non-inflammatory molecule-1) enzyme. | [in vivo]
After a single intravenous injection (2 mg/kg) in rats, PFI-653 (compound 3) has a low clearance rate, a steady-state volume of distribution of 0.84 L/kg, and an effective half-life of 0.5 hours. After oral administration (10 mg/kg), PFI-653 exhibits rapid and almost complete absorption, with a bioavailability of 96%[1].
| [storage]
Store at -20°C | [References]
[1] Casimiro-Garcia A, et al. Discovery of a Series of Pyrimidine Carboxamides as Inhibitors of Vanin-1. J Med Chem. 2022 Jan 13;65 (1) :757-784. DOI:10.1021/acs.jmedchem.1c01849
[2] Agustin Casimiro-Garcia, et al. Novel pyrimidine carboxamides as inhibitors of vanin-1 enzyme. WO2018011681A1. |
|
| Company Name: |
cjbscvictory
|
| Telephone: |
13348960310 13348960310 |
| Website: |
www.weikeqi-biotech.com/ |
| Company Name: |
InvivoChem
|
| Telephone: |
13549236410 |
| Website: |
https://www.invivochem.cn/ |
|