
CAS Number1515856-92-4
Synonyms2-[(3S)-3-(2-Pyridinylmethoxy)-1-pyrrolidinyl]-5-(trifluoromethyl)benzoic acid; (S)-2-(3-(PYRIDIN-2-YLMETHOXY)PYRROLIDIN-1-YL)-5-(TRIFLUOROMETHYL)BENZOIC ACID. HCL; XEN-445; XEN445
Molecular FormulaC18H17F3N2O3
Molecular Weight366.33
Purity≥98 (HPLC)%
Density1.4±0.1 g/cm3
Boiling Point490.9±45.0 °C at 760 mmHg
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1515856-92-4 |
| Catalog No. | 2A-1198792 |
| Chinese Name | 2-[(3S)-3-(2-吡啶基甲氧基)-1-吡咯烷基]-5-(三氟甲基)苯甲酸 |
| Synonyms | 2-[(3S)-3-(2-Pyridinylmethoxy)-1-pyrrolidinyl]-5-(trifluoromethyl)benzoic acid; (S)-2-(3-(PYRIDIN-2-YLMETHOXY)PYRROLIDIN-1-YL)-5-(TRIFLUOROMETHYL)BENZOIC ACID. HCL; XEN-445; XEN445 |
| Molecular Formula | C18H17F3N2O3 |
| Molecular Weight | 366.33 |
| Purity | ≥98 (HPLC) |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 490.9±45.0 °C at 760 mmHg |
| Appearance | powder |
| Storage Condition | -20℃ |
| Application | XEN445 is an endothelial lipase (EL) inhibitor with an IC50 of 0.237 uM. It has good ADME and PK activities and can increase the concentration of high-density lipoprotein cholesterol in mouse plasma. |
| SMILES | FC(F)(F)c1cc(c(cc1)N2C[C@H](CC2)OCc3ncccc3)C(=O)O |
| InChI | 1S/C18H17F3N2O3/c19-18(20,21)12-4-5-16(15(9-12)17(24)25)23-8-6-14(10-23)26-11-13-3-1-2-7-22-13/h1-5,7,9,14H,6,8,10-11H2,(H,24,25)/t14-/m0/s1 |
| InChI Key | NBGRERFNOKZQLO-AWEZNQCLSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/200734_1_1515856_92_4.pdf |
| Transport Info | Product name: XEN445 |
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