ML-179
Bezeichnung:ML-179
CAS-Nr1883548-87-5
Englisch Name:ML-179
CBNumberCB23152683
SummenformelC21H25F3N4O2
Molgewicht422.44
MOL-Datei1883548-87-5.mol
ML-179 physikalisch-chemischer Eigenschaften
| Dichte | 1.329±0.06 g/cm3(Predicted) |
| storage temp. | Store at -20°C |
| Löslichkeit | DMSO: 10 mg/ml |
| Aggregatzustand | A crystalline solid |
| pka | 9.37±0.40(Predicted) |
| InChI | InChI=1S/C21H25F3N4O2/c22-21(23,24)15-5-4-8-17(13-15)26-9-11-27(12-10-26)18-14-19(29)28(20(30)25-18)16-6-2-1-3-7-16/h4-5,8,13-14,16H,1-3,6-7,9-12H2,(H,25,30) |
| InChIKey | MFABFKUNLDYKGH-UHFFFAOYSA-N |
| SMILES | C1(=O)NC(N2CCN(C3=CC=CC(C(F)(F)F)=C3)CC2)=CC(=O)N1C1CCCCC1 |