Prenylamine lactateProduct ingredient for Prenylamine
- Name
- Prenylamine lactate
- Drug Entry
- Prenylamine
Prenylamine was withdrawn from the Canadian, US, and UK markets in 1988 due to concerns regarding cardiac arrhythmias.
- Accession Number
- DBSALT002856
- Structure
- Synonyms
- N-(3,3-Diphenylpropyl)-alpha-methylphenethylamine lactate / Prenylamine lactate
- UNII
- 6J3J6SXI7V
- CAS Number
- 69-43-2
- Weight
- Average: 419.565
Monoisotopic: 419.246043927 - Chemical Formula
- C27H33NO3
- InChI Key
- QPOFIDVRLWJICD-UHFFFAOYSA-N
- InChI
- InChI=1S/C24H27N.C3H6O3/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23;1-2(4)3(5)6/h2-16,20,24-25H,17-19H2,1H3;2,4H,1H3,(H,5,6)
- IUPAC Name
- (3,3-diphenylpropyl)(1-phenylpropan-2-yl)amine; 2-hydroxypropanoic acid
- SMILES
- CC(O)C(O)=O.CC(CC1=CC=CC=C1)NCCC(C1=CC=CC=C1)C1=CC=CC=C1
- External Links
- ChemSpider
- 59000
- ChEMBL
- CHEMBL1367944
- Predicted Properties
Property Value Source Water Solubility 3.54e-05 mg/mL ALOGPS logP 5.89 ALOGPS logP 6.12 Chemaxon logS -7 ALOGPS pKa (Strongest Basic) 10.48 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 12.03 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 107.09 m3·mol-1 Chemaxon Polarizability 39.76 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule Yes Chemaxon