Thonzylamine hydrochlorideProduct ingredient for Thonzylamine

Name
Thonzylamine hydrochloride
Drug Entry
Thonzylamine

Thonzylamine is an antihistamine and anticholinergic drug. It is available as combination products with Clofedanol or Phenylephrine for temporary relief of symptoms of common cold, hay fever (allergic rhinitis) or other upper respiratory allergies.

Accession Number
DBSALT001562
Structure
Synonyms
Thonzylamine HCl
UNII
6K9YKD48Y4
CAS Number
63-56-9
Weight
Average: 322.84
Monoisotopic: 322.1560391
Chemical Formula
C16H23ClN4O
InChI Key
HRYJPHOTGFERGT-UHFFFAOYSA-N
InChI
InChI=1S/C16H22N4O.ClH/c1-19(2)11-12-20(16-17-9-4-10-18-16)13-14-5-7-15(21-3)8-6-14;/h4-10H,11-13H2,1-3H3;1H
IUPAC Name
N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyrimidin-2-amine hydrochloride
SMILES
Cl.COC1=CC=C(CN(CCN(C)C)C2=NC=CC=N2)C=C1
ChemSpider
5906
ChEBI
32219
ChEMBL
CHEMBL1529802
Predicted Properties
PropertyValueSource
Water Solubility0.733 mg/mLALOGPS
logP2.4ALOGPS
logP2.42Chemaxon
logS-2.6ALOGPS
pKa (Strongest Basic)8.62Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area41.49 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity86.19 m3·mol-1Chemaxon
Polarizability32.42 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon