1428652-17-8
| Name | Baxdrostat |
| CAS | 1428652-17-8 |
| Molecular Formula | C22H25N3O2 |
| Molecular Weight | 363.45 |
| MOL File | 1428652-17-8.mol |
Chemical Properties
| Boiling point | 697.6±55.0 °C(Predicted) |
| density | 1.24±0.1 g/cm3(Predicted) |
| solubility | DMSO : 250 mg/mL (687.85 mM; Need ultrasonic) |
| form | Solid |
| pka | 15.05±0.20(Predicted) |
| color | Off-white to light yellow |
| InChI | InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)/t19-/m1/s1 |
| InChIKey | VDEUDSRUMNAXJG-LJQANCHMSA-N |
| SMILES | C(N[C@H]1C2=C(CCC1)C(C1C=CC3=C(C=1)CCC(=O)N3C)=CN=C2)(=O)CC |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302-H315-H319 |
| Precautionary statements | P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330 |