| Chemical & Physical Properties | |
|---|---|
| CAS Number | 552292-08-7 |
| Catalog No. | 2A-1180364 |
| Chinese Name | 罗拉吡坦 |
| Synonyms | UNII-NLE429IZUC; UNII:NLE429IZUC; rolapitant |
| Molecular Formula | C25H26O2N2F6 |
| Molecular Weight | 500.48 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 523.5±50.0 °C at 760 mmHg |
| Appearance | powder |
| Storage Condition | -20℃ |
| Application | Rolapitant (SCH619734) is a highly selective and orally active neurokinin NK1 receptor inhibitor with a Ki value of 0.66 nM. |
| PubChem ID | 15319052 |
| MDL Number | MFCD23105917 |
| SMILES | CC(OCC1(c2ccccc2)CCC2(CCC(=O)N2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
| InChI | InChI=1S/C25H26F6N2O2/c1-16(17-11-19(24(26,27)28)13-20(12-17)25(29,30)31)35-15-23(18-5-3-2-4-6-18)10-9-22(14-32-23)8-7-21(34)33-22/h2-6,11-13,16,32H,7-10,14-15H2,1H3,(H,33,34)/t16-,22-,23-/m1/s1 |
| InChI Key | FIVSJYGQAIEMOC-ZGNKEGEESA-N |
| Transport Info | Product Name: Rolapitant |
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