Ubrogepant Intermediate
化学名:Ubrogepant Intermediate
CAS番号.1375541-21-1
英語名:Ubrogepant Intermediate
CBNumberCB03357950
MFC15H11N3O3
MW281.27
MOL File1375541-21-1.mol
Ubrogepant Intermediate物理性質
| 沸点 | 566.1±50.0 °C(Predicted) |
| 比重(密度) | 1.57±0.1 g/cm3(Predicted) |
| 酸解離定数(Pka) | 2.36±0.20(Predicted) |
| InChI | InChI=1S/C15H11N3O3/c19-13(20)9-4-8-5-15(6-11(8)17-7-9)10-2-1-3-16-12(10)18-14(15)21/h1-4,7H,5-6H2,(H,19,20)(H,16,18,21)/t15-/m0/s1 |
| InChIKey | JZRARRAPRCNVSS-HNNXBMFYSA-N |
| SMILES | C12C[C@@]3(C(=O)NC4=NC=CC=C43)CC1=CC(C(O)=O)=CN=2 |
