Name | Fumarate hydratase-IN-1 |
Synonyms | Fumarate hydratase-IN-1 Fumarate hydratase inhibitor 1 ethyl (3S,3~{a}R)-3-[2-(methylamino)-2-oxoethyl]-2-oxo-1-[(4-phenylphenyl)methyl]-3,4,5,6-tetrahydroindole-3~{a}-carboxylate 3aH-Indole-3a-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)-1,2,3,4,5,6-hexahydro-3-[2-(methylamino)-2-oxoethyl]-2-oxo-, ethyl ester, (3R,3aS)-rel- |
CAS | 1644060-37-6 |
Molecular Formula | C27H30N2O4 |
Molar Mass | 446.54 |
Density | 1.23±0.1 g/cm3(Predicted) |
Boling Point | 693.0±55.0 °C(Predicted) |
Solubility | 10 mM in DMSO |
pKa | 15.97±0.46(Predicted) |
Storage Condition | -20℃ |
In vitro study | Fumarate hydratase-IN-1 inhibits SW620, ACHN, HCT-116, PC3, and SK-MEL-28 cell lines with a mean IC 50 of 2.2 μM. |
1mg | 5mg | 10mg | |
---|---|---|---|
1 mM | 2.239 ml | 11.197 ml | 22.395 ml |
5 mM | 0.448 ml | 2.239 ml | 4.479 ml |
10 mM | 0.224 ml | 1.12 ml | 2.239 ml |
5 mM | 0.045 ml | 0.224 ml | 0.448 ml |
biological activity | Fumarate hydratase-IN-1 (compound 2) is a cell-permeable fumarate hydratase inhibitor. Fumarate hydratase-IN-1 had anti-proliferative activity against several cell lines with a mean IC50 of 2.2 μm. |
Target | Fumarate hydratase |