Chemical Property of Emodepside
Chemical Property:
- Boiling Point:1219.3±65.0 °C(Predicted)
- PKA:5.34±0.40(Predicted)
- PSA：211.38000
- Density:1.104±0.06 g/cm3(Predicted)
- LogP:5.21960
- Storage Temp.:2-8°C
- XLogP3:9
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:16
- Rotatable Bond Count:14
- Exact Mass:1118.65150157
- Heavy Atom Count:80
- Complexity:1900
- Purity/Quality:
-
99% *data from raw suppliers
Emodepside >98% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)O1)CC(C)C)C)CC2=CC=C(C=C2)N3CCOCC3)CC(C)C)C)C)CC(C)C)C)CC4=CC=C(C=C4)N5CCOCC5)CC(C)C)C
- Isomeric SMILES:C[C@@H]1C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O1)CC(C)C)C)CC2=CC=C(C=C2)N3CCOCC3)CC(C)C)C)C)CC(C)C)C)CC4=CC=C(C=C4)N5CCOCC5)CC(C)C)C
- Recent ClinicalTrials:Efficacy and Safety of Emodepside in Adolescents and Adults Infected With Hookworm
