Imolamine hydrochlorideProduct ingredient for Imolamine

Name
Imolamine hydrochloride
Drug Entry
Imolamine

Imolamine is a compound with a molecular weight of 260.33 g/mol with the formula diethyl[2-{5-imino-3-phenyl-4,5-dihydro-1,2,3-oxadiazol,-4-yl)ethyl]amine. It is developed under the brand name Coremax by Novartis consumer health SA.

Accession Number
DBSALT001282
Structure
Synonyms
Imolamine HCl
UNII
YJ3KV70R41
CAS Number
15823-89-9
Weight
Average: 296.8
Monoisotopic: 296.140389
Chemical Formula
C14H21ClN4O
InChI Key
OMMBWIJMWMSGBX-UHFFFAOYSA-N
InChI
InChI=1S/C14H20N4O.ClH/c1-3-17(4-2)10-11-18-13(16-19-14(18)15)12-8-6-5-7-9-12;/h5-9,15H,3-4,10-11H2,1-2H3;1H
IUPAC Name
diethyl[2-(5-imino-3-phenyl-4,5-dihydro-1,2,4-oxadiazol-4-yl)ethyl]amine hydrochloride
SMILES
Cl.CCN(CC)CCN1C(=N)ON=C1C1=CC=CC=C1
ChemSpider
19957623
Predicted Properties
PropertyValueSource
Water Solubility0.162 mg/mLALOGPS
logP1.92ALOGPS
logP2.78Chemaxon
logS-3.2ALOGPS
pKa (Strongest Basic)8.17Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area51.92 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity87.17 m3·mol-1Chemaxon
Polarizability28.9 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon