Pirenzepine hydrochlorideProduct ingredient for Pirenzepine

Name
Pirenzepine hydrochloride
Drug Entry
Pirenzepine

An antimuscarinic agent that inhibits gastric secretion at lower doses than are required to affect gastrointestinal motility, salivary, central nervous system, cardiovascular, ocular, and urinary function. It promotes the healing of duodenal ulcers and due to its cytoprotective action is beneficial in the prevention of duodenal ulcer recurrence. It also potentiates the effect of other antiulcer agents such as cimetidine and ranitidine. It is generally well tolerated by patients.

Accession Number
DBSALT001002
Structure
Synonyms
Pirenzepine HCl
UNII
10YM403FLS
CAS Number
29868-97-1
Weight
Average: 424.33
Monoisotopic: 423.1228804
Chemical Formula
C19H23Cl2N5O2
InChI Key
FFNMBRCFFADNAO-UHFFFAOYSA-N
InChI
InChI=1S/C19H21N5O2.2ClH/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24;;/h2-8H,9-13H2,1H3,(H,21,26);2*1H
IUPAC Name
2-[2-(4-methylpiperazin-1-yl)acetyl]-2,4,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one dihydrochloride
SMILES
Cl.Cl.CN1CCN(CC(=O)N2C3=CC=CC=C3C(=O)NC3=C2N=CC=C3)CC1
ChemSpider
64497
ChEBI
32014
ChEMBL
CHEMBL1531864
Predicted Properties
PropertyValueSource
Water Solubility0.682 mg/mLALOGPS
logP1.26ALOGPS
logP0.97Chemaxon
logS-2.7ALOGPS
pKa (Strongest Acidic)12.02Chemaxon
pKa (Strongest Basic)7.2Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area68.78 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity100.93 m3·mol-1Chemaxon
Polarizability36.76 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon