Benazepril hydrochlorideProduct ingredient for Benazepril
- Name
- Benazepril hydrochloride
- Drug Entry
- Benazepril
Benazepril, brand name Lotensin, is a medication used to treat high blood pressure (hypertension), congestive heart failure, and chronic renal failure3,2. Upon cleavage of its ester group by the liver, benazepril is converted into its active form benazeprilat, a non-sulfhydryl angiotensin-converting enzyme (ACE) inhibitor1.
- Accession Number
- DBSALT000554
- Structure
Structure for Benazepril hydrochloride (DBSALT000554)
- Synonyms
- Benazepril HCl
- UNII
- N1SN99T69T
- CAS Number
- 86541-74-4
- Weight
- Average: 460.95
Monoisotopic: 460.176499755 - Chemical Formula
- C24H29ClN2O5
- InChI Key
- VPSRQEHTHIMDQM-FKLPMGAJSA-N
- InChI
- InChI=1S/C24H28N2O5.ClH/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28;/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28);1H/t19-,20-;/m0./s1
- IUPAC Name
- 2-[(3S)-3-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid hydrochloride
- SMILES
- Cl.[H][C@@](CCC1=CC=CC=C1)(N[C@@]1([H])CCC2=CC=CC=C2N(CC(O)=O)C1=O)C(=O)OCC
- External Links
- KEGG Compound
- C07701
- PubChem Compound
- 5362123
- ChemSpider
- 4514934
- ChEBI
- 3012
- ChEMBL
- CHEMBL1694
- Wikipedia
- Benazepril
- Predicted Properties
Property Value Source Water Solubility 0.0105 mg/mL ALOGPS logP 1.14 ALOGPS logP 1.54 Chemaxon logS -4.6 ALOGPS pKa (Strongest Acidic) 3.53 Chemaxon pKa (Strongest Basic) 5.36 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 95.94 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 115.23 m3·mol-1 Chemaxon Polarizability 45.28 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon