Benazeprilat

Base Information

Chemical Name:Benazeprilat
CAS No.:86541-78-8
Deprecated CAS:89747-91-1,107397-09-1
Molecular Formula:C22H24N2O5
Molecular Weight:396.443
Hs Code.:2933790002
UNII:JRM708L703
DSSTox Substance ID:DTXSID501024701
Nikkaji Number:J227.999A
Wikidata:Q27075017
NCI Thesaurus Code:C72907
RXCUI:1546196
Pharos Ligand ID:DWTMWPUANK11
Metabolomics Workbench ID:71825
ChEMBL ID:CHEMBL1192519
Mol file:86541-78-8.mol

Synonyms:benazeprilat;benezaprilat;CGS 14831;CGS-14831

Suppliers and Price of Benazeprilat

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
Benazeprilat
5mg
$ 425.00

TRC
Benazeprilat
25mg
$ 450.00

Cayman Chemical
Benazeprilat ≥98%
10mg
$ 440.00

Cayman Chemical
Benazeprilat ≥98%
1mg
$ 55.00

Cayman Chemical
Benazeprilat ≥98%
5mg
$ 234.00

Biosynth Carbosynth
Benazeprilat
10 mg
$ 200.00

Biosynth Carbosynth
Benazeprilat
25 mg
$ 350.00

Biosynth Carbosynth
Benazeprilat
2 mg
$ 70.00

Biosynth Carbosynth
Benazeprilat
5 mg
$ 125.00

AvaChem
Benazeprilat
5mg
$ 105.00

Total 34 raw suppliers

Chemical Property of Benazeprilat

Chemical Property:

Appearance/Colour:Crystalline Solid
Vapor Pressure:3.09E-21mmHg at 25°C
Melting Point:270-272°C
Refractive Index:1.643
Boiling Point:711.3 °C at 760 mmHg
PKA:2.17±0.10(Predicted)
Flash Point:384 °C
PSA：106.94000
Density:1.34 g/cm³
LogP:2.55050
Storage Temp.:-20°C Freezer, Under Inert Atmosphere
Solubility.:Aqueous Base (Slightly), DMSO (Slightly)
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:396.16852187
Heavy Atom Count:29
Complexity:590

Purity/Quality:

98% Min ^*data from raw suppliers

Benazeprilat ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2=CC=CC=C2N(C(=O)C1NC(CCC3=CC=CC=C3)C(=O)O)CC(=O)O
Isomeric SMILES:C1CC2=CC=CC=C2N(C(=O)[C@H]1N[C@@H](CCC3=CC=CC=C3)C(=O)O)CC(=O)O
Uses Benazeprilat is a metabolite of Benazepril, which is used as an antihypertensive.

Technology Process of Benazeprilat

There total 12 articles about Benazeprilat which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 69.0%

: 86541-77-7,215447-89-5,88372-38-7
(3S)-1-(carboxymethyl)-<<(1S)-1-(ethoxycarbonyl)-3-phenylpropyl>amino>-2,3,4,5-tetrahydro-1H-<1>benzazepin-2-one hydrochloride

: 86541-78-8,89747-91-1
(3S)-1-(carboxymethyl)-<<(1S)-1-carboxy-3-phenylpropyl>amino>-2,3,4,5-tetrahydro-1H-<1>benzazepin-2-one

Guidance literature:: With sodium hydroxide; In methanol; for 18h; Ambient temperature;
DOI:10.1021/jm00148a023

Reference yield:

: 86541-75-5,86499-21-0
benazepril

: 64-17-5
ethanol

: 86541-78-8,89747-91-1
benazeprilate

Guidance literature:: With Tris-HCl buffer; human liver carboxylesterase pI 4.5; at 37 ℃; pH=7.4; Further Variations:; Reagents; Enzyme kinetics;
DOI:10.1248/bpb.20.869