Products for Research Use Only
RegisterLogin

Antileishmanial agent-11

CAT: 0804-HY-147856Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-147856Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Antileishmanial agent-11 (compound 4d) is a potent anti-leishmanial agent. Antileishmanial agent-11 shows antiprotozoal activity against Leishmania brazilensis, Leishmania infantum, and T. cruzi, with IC50 values of 28.3, 24.8 and 13.0 μM, respectively[1].
CAS Number
2253635-71-9
UNSPSC
12352005
Target
Parasite
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/antileishmanial-agent-11.html
Solubility
10 mM in DMSO
Smiles
O=C(OC(C1=O)=C(C/C=C(C)\C)C(C2=C1C=CC=C2)=O)CCCC3=CN(C4=CC=C(Cl)C=C4)N=N3
Molecular Formula
C27H24ClN3O4
Molecular Weight
489.95
References & Citations
[1]Pertino MW, et al. Synthesis, trypanocidal and anti-leishmania activity of new triazole-lapachol and nor-lapachol hybrids. Bioorg Chem. 2020 Oct;103:104122.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Leishmania

Chemical Information

Antileishmanial agent-11
CAS Number2253635-71-9
PubChem CID164517096
IUPAC Name[3-(3-methylbut-2-enyl)-1,4-dioxonaphthalen-2-yl] 4-[1-(4-chlorophenyl)triazol-4-yl]butanoate
Molecular FormulaC27H24ClN3O4
Molecular Weight489.9
XLogP5.7
Topological Polar Surface Area91.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count35
Formal Charge0
Complexity874
SMILES
CC(=CCC1=C(C(=O)C2=CC=CC=C2C1=O)OC(=O)CCCC3=CN(N=N3)C4=CC=C(C=C4)Cl)C
InChI
InChI=1S/C27H24ClN3O4/c1-17(2)10-15-23-25(33)21-7-3-4-8-22(21)26(34)27(23)35-24(32)9-5-6-19-16-31(30-29-19)20-13-11-18(28)12-14-20/h3-4,7-8,10-14,16H,5-6,9,15H2,1-2H3
InChIKey
RKHHAANAPIAQJB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Antileishmanial agent-11
CAS: 2253635-71-9
CID: 164517096
Formula: C27H24ClN3O4
MW: 489.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight489.9
XLogP35.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass489.1455339
Monoisotopic Mass489.1455339
Topological Polar Surface Area91.2 Ų
Heavy Atom Count35
Formal Charge0
Complexity874
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-178784Antileishmanial agent-37
HY-170358Antileishmanial agent-31
HY-W097659-01Antileishmanial agent-32
HY-155845Antileishmanial agent-21
HY-132905Antileishmanial agent-2
HY-147857Antileishmanial agent-12
HY-155301Antileishmanial agent-24
HY-156427Antileishmanial agent-25
HY-138812-01Antileishmanial agent-28
HY-162498Antileishmanial agent-29

Alternative Products

CatalogName
MBS5805952Antileishmanial agent-11
T209461-01Antileishmanial agent-27
T206081-01Antileishmanial agent-33
T62574-01Antileishmanial agent-6
T61100-01Antileishmanial agent-4
T79632-01Antileishmanial agent-21
MBS5824695Antileishmanial agent-25
MBS5820342Antileishmanial agent-14
MBS5804411Antileishmanial agent-7
MBS5804264Antileishmanial agent-5

Popular Products

Antileishmanial agent-11 | 0804-HY-147856 | Gentaur