Carbinoxamine maleateProduct ingredient for Carbinoxamine

Name
Carbinoxamine maleate
Drug Entry
Carbinoxamine

Carbinoxamine is a first generation antihistamine that competes with free histamine for binding at HA-receptor sites. This antagonizes the effects of histamine on HA-receptors, leading to a reduction of the negative symptoms brought on by histamine HA-receptor binding. The product label for carbinoxamine as an over the counter cough and cold medicine is being modified to state "do not use" in children under 4 years of age in order to prevent and reduce misuse, as many unapproved carbinoxamine-containing preparations contained inappropriate labeling, which promoted unapproved uses (including management of congestion, cough, the common cold, and the use in children under 2 years of age), which can potentially cause serious health risks.

Accession Number
DBSALT000963
Structure
Synonyms
Not Available
UNII
02O55696WH
CAS Number
3505-38-2
Weight
Average: 406.86
Monoisotopic: 406.1295495
Chemical Formula
C20H23ClN2O5
InChI Key
GVNWHCVWDRNXAZ-BTJKTKAUSA-N
InChI
InChI=1S/C16H19ClN2O.C4H4O4/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-10,16H,11-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
IUPAC Name
(2Z)-but-2-enedioic acid; {2-[(4-chlorophenyl)(pyridin-2-yl)methoxy]ethyl}dimethylamine
SMILES
[H]\C(=C(/[H])C(O)=O)C(O)=O.CN(C)CCOC(C1=CC=C(Cl)C=C1)C1=CC=CC=N1
ChemSpider
4445564
ChEBI
31353
ChEMBL
CHEMBL1200974
Wikipedia
Carbinoxamine
Predicted Properties
PropertyValueSource
Water Solubility0.228 mg/mLALOGPS
logP3.03ALOGPS
logP3.27Chemaxon
logS-3.1ALOGPS
pKa (Strongest Basic)8.87Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area25.36 Å2Chemaxon
Rotatable Bond Count8Chemaxon
Refractivity82.13 m3·mol-1Chemaxon
Polarizability31.63 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon