Aminopentamide sulfateProduct ingredient for Aminopentamide

Name
Aminopentamide sulfate
Drug Entry
Aminopentamide
Accession Number
DBSALT002911
Structure
Synonyms
Aminopentamide sulfate / Aminopentamide sulphate / Dimevamide sulfate / Dimevamide sulphate
UNII
20P9NI883O
CAS Number
20701-77-3
Weight
Average: 394.49
Monoisotopic: 394.156243119
Chemical Formula
C19H26N2O5S
InChI Key
GEKOQGPXZRQQHJ-UHFFFAOYSA-N
InChI
InChI=1S/C19H24N2O.H2O4S/c1-15(21(2)3)14-19(18(20)22,16-10-6-4-7-11-16)17-12-8-5-9-13-17;1-5(2,3)4/h4-13,15H,14H2,1-3H3,(H2,20,22);(H2,1,2,3,4)
IUPAC Name
4-(dimethylamino)-2,2-diphenylpentanamide; sulfuric acid
SMILES
OS(O)(=O)=O.CC(CC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1)N(C)C
ChemSpider
153459
ChEMBL
CHEMBL3561133
Predicted Properties
PropertyValueSource
Water Solubility0.0292 mg/mLALOGPS
logP2.61ALOGPS
logP3.17Chemaxon
logS-4ALOGPS
pKa (Strongest Acidic)16.45Chemaxon
pKa (Strongest Basic)9.71Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area46.33 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity90.91 m3·mol-1Chemaxon
Polarizability33.25 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon