Fominoben hydrochlorideProduct ingredient for Fominoben

Name
Fominoben hydrochloride
Drug Entry
Fominoben

Fominoben is an antitussive agent.

Accession Number
DBSALT002831
Structure
Synonyms
Fominoben HCl
External IDs
PB 89 / PB 89CL / PB-89 / PB-89CL
UNII
XCT2R4OS1G
CAS Number
24600-36-0
Weight
Average: 438.35
Monoisotopic: 437.1272971
Chemical Formula
C21H25Cl2N3O3
InChI Key
ZAOHKACVOFGZOI-UHFFFAOYSA-N
InChI
InChI=1S/C21H24ClN3O3.ClH/c1-24(15-20(26)25-10-12-28-13-11-25)14-17-18(22)8-5-9-19(17)23-21(27)16-6-3-2-4-7-16;/h2-9H,10-15H2,1H3,(H,23,27);1H
IUPAC Name
N-[3-chloro-2-({methyl[2-(morpholin-4-yl)-2-oxoethyl]amino}methyl)phenyl]benzamide hydrochloride
SMILES
Cl.CN(CC(=O)N1CCOCC1)CC1=C(Cl)C=CC=C1NC(=O)C1=CC=CC=C1
ChemSpider
392023
ChEBI
31631
ChEMBL
CHEMBL2356122
Predicted Properties
PropertyValueSource
Water Solubility0.0303 mg/mLALOGPS
logP2.96ALOGPS
logP2.51Chemaxon
logS-4.1ALOGPS
pKa (Strongest Acidic)15.49Chemaxon
pKa (Strongest Basic)5.55Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area61.88 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity111.71 m3·mol-1Chemaxon
Polarizability42.16 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon