Propiopromazine hydrochlorideProduct ingredient for Propiopromazine

Name
Propiopromazine hydrochloride
Drug Entry
Propiopromazine
Accession Number
DBSALT001697
Structure
Synonyms
Propionylpromazine hydrochloride / Propiopromazine HCl
UNII
U0BND6SD2I
CAS Number
7681-67-6
Weight
Average: 376.94
Monoisotopic: 376.1376123
Chemical Formula
C20H25ClN2OS
InChI Key
ZFWVWZODBGTOIL-UHFFFAOYSA-N
InChI
InChI=1S/C20H24N2OS.ClH/c1-4-18(23)15-10-11-20-17(14-15)22(13-7-12-21(2)3)16-8-5-6-9-19(16)24-20;/h5-6,8-11,14H,4,7,12-13H2,1-3H3;1H
IUPAC Name
1-{10-[3-(dimethylamino)propyl]-10H-phenothiazin-2-yl}propan-1-one hydrochloride
SMILES
Cl.CCC(=O)C1=CC=C2SC3=C(C=CC=C3)N(CCCN(C)C)C2=C1
ChemSpider
22767
ChEMBL
CHEMBL1256661
Predicted Properties
PropertyValueSource
Water Solubility0.00538 mg/mLALOGPS
logP4.74ALOGPS
logP4.19Chemaxon
logS-4.8ALOGPS
pKa (Strongest Acidic)16.76Chemaxon
pKa (Strongest Basic)9.11Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area23.55 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity103.98 m3·mol-1Chemaxon
Polarizability39.5 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleYesChemaxon