Fenoterol hydrobromideProduct ingredient for Fenoterol

Name
Fenoterol hydrobromide
Drug Entry
Fenoterol

Fenoterol is an adrenergic beta-2 agonist that is used as a bronchodilator and tocolytic.

Accession Number
DBSALT001185
Structure
Synonyms
Not Available
UNII
RLI45Z99RB
CAS Number
1944-12-3
Weight
Average: 384.27
Monoisotopic: 383.073221
Chemical Formula
C17H22BrNO4
InChI Key
SGZRQMALQBXAIQ-NRNQBQMASA-N
InChI
InChI=1S/C17H21NO4.BrH/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13;/h2-5,7-9,11,17-22H,6,10H2,1H3;1H/t11-,17+;/m1./s1
IUPAC Name
5-[(1R)-1-hydroxy-2-{[(2R)-1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl]benzene-1,3-diol hydrobromide
SMILES
Br.C[C@H](CC1=CC=C(O)C=C1)NC[C@H](O)C1=CC(O)=CC(O)=C1
ChemSpider
32700924
Predicted Properties
PropertyValueSource
Water Solubility0.162 mg/mLALOGPS
logP1.36ALOGPS
logP1.47Chemaxon
logS-3.3ALOGPS
pKa (Strongest Acidic)8.85Chemaxon
pKa (Strongest Basic)9.63Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count5Chemaxon
Polar Surface Area92.95 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity85 m3·mol-1Chemaxon
Polarizability32.88 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon