| Identification | Back Directory | [Name]
ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate | [CAS]
110448-29-8 | [Synonyms]
Nifetepimine
Nifetepimine >=95% (HPLC)
ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(3-nitrophenyl)-2-oxo-, ethyl ester | [Molecular Formula]
C14H15N3O5 | [MDL Number]
MFCD00128568 | [MOL File]
110448-29-8.mol | [Molecular Weight]
305.29 |
| Chemical Properties | Back Directory | [Melting point ]
226-227.5 °C | [Boiling point ]
444.3±45.0 °C(Predicted) | [density ]
1.302±0.06 g/cm3(Predicted) | [storage temp. ]
2-8°C | [solubility ]
DMSO: 10mg/mL, clear | [form ]
powder | [pka]
10.86±0.70(Predicted) | [color ]
white to beige | [InChI]
1S/C14H15N3O5/c1-3-22-13(18)11-8(2)15-14(19)16-12(11)9-5-4-6-10(7-9)17(20)21/h4-7,12H,3H2,1-2H3,(H2,15,16,19) | [InChIKey]
PPBNQKLDXXHPMH-UHFFFAOYSA-N | [SMILES]
O=C(OCC)C1=C(C)NC(NC1C2=CC([N+]([O-])=O)=CC=C2)=O |
| Safety Data | Back Directory | [WGK Germany ]
WGK 3 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Irrit. 2 |
| Hazard Information | Back Directory | [Biological Activity]
Nifetepimine is a dihydropyrimidone calcium channel blocker th at down-modulates SERCA3 (sarco/endoplasmic reticulum Ca2+ -ATPase 3) pumpand protects of the CD4+ T cells from tumor-induced apoptosis. Nifetepimine induces apoptotic cell death in triple negative breast cancer (TNBC) cells by stimulation of cross-talk between ER stress and the MEK/ERK pathway. |
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Energy Chemical
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Merck KGaA
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