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Ethacridine (lactate monohydrate)

CAT: 0804-HY-B0889-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B0889-01Size:50 mg
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Description
Ethacridine lactate (Acrinol) monohydrate is a widely used antiseptic and abortifacient. Ethacridine lactate monohydrate is effective against Staphylococcus aureus and other gram-positive cocci. Ethacridine lactate monohydrate is also a poly (ADP-ribose) glycohydrolase (PARG) inhibitor[1][2][3].
CAS Number
6402-23-9
Product Name Alternative
Acrinol (monohydrate)
UNSPSC
12352005
Hazard Statement
H315, H319, H335
Target
Bacterial
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/Ethacridine-lactate-monohydrate.html
Purity
99.85
Solubility
DMSO : ≥ 100 mg/mL|H2O : 2 mg/mL (ultrasonic)
Smiles
CC(O)C(O)=O.NC1=CC2=NC3=CC=C(OCC)C=C3C(N)=C2C=C1.O
Molecular Formula
C18H23N3O5
Molecular Weight
361.39
Precautions
H315, H319, H335
References & Citations
[1]Rotin LE, et al. Erlotinib synergizes with the poly (ADP-ribose) glycohydrolase inhibitor ethacridine in acute myeloid leukemia cells. Haematologica. 2016 Nov;101 (11) :e449-e453.|[2]Gupta S, et, al. Ethacridine lactate -- a safe and effective drug for termination of pregnancy. Indian J Matern Child Health. 1993;4 (2) :59-61.|[3]Usuki R, et, al. Antibacterial Activity of Acrinol against Organisms Isolated from Clinical Materials and Influence of Light on Antibacterial Activity of Acrinol. Japanese Journal of Pharmaceutical Health Care and Sciences. 2004 Jan; 30 (2) :72-77.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound1
Clinical Information
Launched

Chemical Information

Propanoic acid, 2-hydroxy-, compd. with 7-ethoxy-3,9-acridinediamine, hydrate (1:1:1)
CAS Number6402-23-9
PubChem CID165457
IUPAC Name7-ethoxyacridine-3,9-diamine;2-hydroxypropanoic acid;hydrate
Molecular FormulaC18H23N3O5
Molecular Weight361.4
Topological Polar Surface Area133
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity371
SMILES
CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N.CC(C(=O)O)O.O
InChI
InChI=1S/C15H15N3O.C3H6O3.H2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13;1-2(4)3(5)6;/h3-8H,2,16H2,1H3,(H2,17,18);2,4H,1H3,(H,5,6);1H2
InChIKey
NYEPHMYJRNWPLA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propanoic acid, 2-hydroxy-, compd. with 7-ethoxy-3,9-acridinediamine, hydrate (1:1:1)
CAS: 6402-23-9
CID: 165457
Formula: C18H23N3O5
MW: 361.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight361.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass361.16377084
Monoisotopic Mass361.16377084
Topological Polar Surface Area133 Ų
Heavy Atom Count26
Formal Charge0
Complexity371
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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