Enalapril - CAS 75847-73-3

Name: Enalapril
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB035417
Product Name:	Enalapril
CAS:	75847-73-3
Synonyms:	(2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Application:	Enalapril is used in the treatment of hypertension, congestive heart failure, myocardial infarction, and diabetic nephropathies. lt decreases levels of angiotensin II leading to less vasoconstriction and decreased blood pressure by inhibiting ACE. lt lowers the death rate in systolic heart failure.

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Related CAS:	76095-16-4 (Maleate)
IUPAC Name:	(2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Description:	Enalapril is an angiotensin converting enzyme (ACE) inhibitor used in the treatment of hypertension, congestive heart failure, myocardial infarction, and diabetic nephropathies. Its IC50 values range from 2 to 800 nM. lt belongs to a class of medications called angiotensin converting enzyme inhibitors. pressure. lt decreases levels of angiotensin II leading to less vasoconstriction and decreased blood pressure by inhibiting ACE. lt has been shown to lower the death rate in systolic heart failure. It is on the World Health Organization's List of Essential Medicines, the most important medications needed in a basic health system.
Molecular Weight:	376.45
Molecular Formula:	C20H28N2O5
Canonical SMILES:	CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)O
InChI:	InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1
InChI Key:	GBXSMTUPTTWBMN-XIRDDKMYSA-N
Boiling Point:	582.4±50.0 °C \| Condition: Press: 760 Torr
Melting Point:	143-144 °C
Purity:	98 %
Density:	1.204±0.06 g/cm³ \| Condition: Temp: 20 °C Press: 760 Torr
Solubility:	DMSO 99 mg/mL; Water <1 mg/Ml
Appearance:	White needle like crystal or crystalline powder
Storage:	-20 °C Freezer
LogP:	1.93340
Quality Standard:	In-house standard
Stability:	Stable under recommended storage conditions. /enalapril maleate/
Vapor Pressure:	1.06X10-12 mm Hg at 25 °C (est)

GHS Hazard Statement:	H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement:	P201, P202, P261, P272, P280, P281, P302+P352, P308+P313, P321, P333+P313, P363, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-113480597-A	ACE inhibitory peptide derived from perilla seed meal as well as preparation method and application thereof	20210729
CN-113181332-A	Medicine for treating heart failure and preparation method thereof	20210604
CN-113324933-A	Method for detecting angiotensin converting enzyme and application thereof	20210601
CN-113321719-A	Oligopeptide, and preparation method and application thereof	20210520
CN-113288906-A	Composition containing adriamycin and application thereof	20210519

PMID	Publication Date	Title	Journal
31887396	20200201	Egr1/p300/ACE signal mediates postnatal osteopenia in female rat offspring induced by prenatal ethanol exposure	Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association
31306001	20190808	Modifications on the Amino-3,5-dicyanopyridine Core To Obtain Multifaceted Adenosine Receptor Ligands with Antineuropathic Activity	Journal of medicinal chemistry
30940551	20190701	Exposure to diisononyl phthalate induced an increase in blood pressure through activation of the ACE/ AT1R axis and inhibition of NO production	Toxicology letters
31165171	20190604	Investigations on the Relationship between Ovarian, Endocrine, and Renal Findings in Nonclinical Safety Studies of the γ-secretase Inhibitor Avagacestat	Toxicological sciences : an official journal of the Society of Toxicology
30623541	20190501	Hesperidin regresses cardiac hypertrophy by virtue of PPAR-γ agonistic, anti-inflammatory, antiapoptotic, and antioxidant properties	Journal of biochemical and molecular toxicology

Complexity:	519
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	3
Defined Bond Stereocenter Count:	0
Exact Mass:	376.19982200
Formal Charge:	0
Heavy Atom Count:	27
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	376.19982200
Rotatable Bond Count:	10
Topological Polar Surface Area:	95.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1

Enalapril - CAS 75847-73-3

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

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