| Identification | Back Directory | [Name]
Vps | [CAS]
1383716-46-8 | [Synonyms]
Vps
Compound 19
PIK-III analogue
VPS34 inhibitor 1
Compound 19, PIK-III analogue
VPS34 inhibitor 1 (PIK-III analogue)
VPS34 inhibitor 1 (Compound 19, PIK-III analogue)
1-((4'-(cyclopropylmethyl)-2-(pyridin-4-ylamino)-[4,5'-bipyrimidin]-2'-yl)amino)-2-methylpropan-2-ol
2-Propanol, 1-[[4'-(cyclopropylmethyl)-2-(4-pyridinylamino)[4,5'-bipyrimidin]-2'-yl]amino]-2-methyl-
1-?[[4'-?(Cyclopropylmethyl)?-?2-?(4-?pyridinylamino)?[4,?5'-?bipyrimidin]?-?2'-?yl]?amino]?-?2-?methyl-2-?propanol | [Molecular Formula]
C21H25N7O | [MDL Number]
MFCD31718218 | [MOL File]
1383716-46-8.mol | [Molecular Weight]
391.47 |
| Chemical Properties | Back Directory | [Boiling point ]
676.1±65.0 °C(Predicted) | [density ]
1.324±0.06 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMSO: 78 mg/mL (199.25 mM);Ethanol: Insoluble | [form ]
Solid | [pka]
14.68±0.29(Predicted) | [color ]
White to off-white | [Water Solubility ]
Water: Insoluble |
| Hazard Information | Back Directory | [Uses]
1-?[[4''-?(Cyclopropylmethyl)?-?2-?(4-?pyridinylamino)?[4,?5''-?bipyrimidin]?-?2''-?yl]?amino]?-?2-?methyl-2-?propanol is a selective PI 3-?kinase VPS34 inhibitor. VPS34 inhibitors can be used to investigate autophagy, a degradation process that recycles cellular components. | [Synthesis]
Synthesis of 1-((4'-(cyclopropylmethyl)-2-(pyridin-4-ylamino)-[4,5'-bipyridin]-2'-yl)amino)-2-methylpropan-2-ol (1 Ot): a new synthesis of 1-((4'-(cyclopropylmethyl)-2-(pyridin-4-ylamino)-[4,5'-bipyridin]-2'-yl)amino)-2-methylpropan-2-ol (1 Ot) was carried out by adding a new synthesizer to the (Z)-1-cyclopropyl-4-(dimethylamino)-3-(2-( pyridin-4-ylamino)pyrimidin-4-yl)but-3-en-2-one (9) (50 mg, 0.155 mmol) was added to a solution of 1-(2-hydroxy-2-methylpropyl)guanidine and potassium carbonate (107 mg, 0.773 mmol) in DMF (1288 μL). The reaction mixture was stirred at 120 °C for 2 hours. Upon completion of the reaction, the crude product was purified by reversed-phase HPLC (gradient: 30-90% organic phase, 15 min), followed by further purification using Biotage? silica gel chromatography (10 g SNAP column, elution gradient: 100% DCM to 12% MeOH/DCM) to afford the target product (23.8 mg, 39% yield). | [References]
[1] Patent: WO2012/85815, 2012, A1. Location in patent: Page/Page column 65-66
[2] ACS Medicinal Chemistry Letters, 2016, vol. 7, # 1, p. 72 - 76 |
|
| Company Name: |
parabiochem
|
| Tel: |
025-83453382-8005 |
| Website: |
www.parabiochem.cn |
|