Zilpaterol hydrochlorideProduct ingredient for Zilpaterol
- Name
- Zilpaterol hydrochloride
- Drug Entry
- Zilpaterol
Zilpaterol is a β2 adrenergic agonist sold under the trade name, Zilmax, produced by Intervet, a subsidiary of Merck & Co. Zilpaterol is typically fed to cattle in the last three to six weeks of life with a brief washout period to clear the drug from the tissues before slaughter.
- Accession Number
- DBSALT001665
- Structure
Structure for Zilpaterol hydrochloride (DBSALT001665)
- Synonyms
- Zilpaterol HCl
- UNII
- EX8IEP25JU
- CAS Number
- 119520-06-8
- Weight
- Average: 297.78
Monoisotopic: 297.1244046 - Chemical Formula
- C14H20ClN3O2
- InChI Key
- GIEFXLLRTJNFGT-LOCPCMAASA-N
- InChI
- InChI=1S/C14H19N3O2.ClH/c1-8(2)15-11-6-7-17-12-9(13(11)18)4-3-5-10(12)16-14(17)19;/h3-5,8,11,13,15,18H,6-7H2,1-2H3,(H,16,19);1H/t11-,13-;/m1./s1
- IUPAC Name
- (9R,10R)-9-hydroxy-10-[(propan-2-yl)amino]-1,3-diazatricyclo[6.4.1.0^{4,13}]trideca-4,6,8(13)-trien-2-one hydrochloride
- SMILES
- Cl.CC(C)N[C@@H]1CCN2C(=O)NC3=CC=CC([C@H]1O)=C23
- External Links
- ChemSpider
- 9682455
- ChEMBL
- CHEMBL513390
- Predicted Properties
Property Value Source Water Solubility 2.01 mg/mL ALOGPS logP 0.3 ALOGPS logP 0.84 Chemaxon logS -2.1 ALOGPS pKa (Strongest Acidic) 12.8 Chemaxon pKa (Strongest Basic) 9.14 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 64.6 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 74.06 m3·mol-1 Chemaxon Polarizability 28.16 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon