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IM-93

CAT: 0804-HY-138201-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-138201-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
IM-93 inhibits ferroptosis and NETosis with an IC50 of 0.45 µM for cell death inhibition[1].
CAS Number
1173657-73-2
UNSPSC
12352005
Target
Ferroptosis
Type
Reference compound
Related Pathways
Apoptosis
Applications
Neuroscience-Neuromodulation
Field of Research
Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/im-93.html
Purity
99.00
Solubility
DMSO : 20 mg/mL (ultrasonic; warming)
Smiles
O=C(C(NCCCN(C)C)=C1C2=CN(C)C3=C2C=CC=C3)N(C(C)C)C1=O
Molecular Formula
C21H28N4O2
Molecular Weight
368.47
References & Citations
[1]Dodo K, et al. Development of a Water-Soluble Indolylmaleimide Derivative IM-93 Showing Dual Inhibition of Ferroptosis and NETosis. ACS Med Chem Lett. 2019;10 (9) :1272-1278. Published 2019 Jul 30.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

1-Isopropyl-3-(1-methyl-1H-indole-3-yl)-4-[3-(dimethylamino)propylamino]-1H-pyrrole-2,5-dione
CAS Number1173657-73-2
PubChem CID102174970
IUPAC Name3-[3-(dimethylamino)propylamino]-4-(1-methylindol-3-yl)-1-propan-2-ylpyrrole-2,5-dione
Molecular FormulaC21H28N4O2
Molecular Weight368.5
XLogP2.6
Topological Polar Surface Area57.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity613
SMILES
CC(C)N1C(=O)C(=C(C1=O)NCCCN(C)C)C2=CN(C3=CC=CC=C32)C
InChI
InChI=1S/C21H28N4O2/c1-14(2)25-20(26)18(19(21(25)27)22-11-8-12-23(3)4)16-13-24(5)17-10-7-6-9-15(16)17/h6-7,9-10,13-14,22H,8,11-12H2,1-5H3
InChIKey
DKUCOVGKUCYQLB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Isopropyl-3-(1-methyl-1H-indole-3-yl)-4-[3-(dimethylamino)propylamino]-1H-pyrrole-2,5-dione
CAS: 1173657-73-2
CID: 102174970
Formula: C21H28N4O2
MW: 368.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight368.5
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass368.22122615
Monoisotopic Mass368.22122615
Topological Polar Surface Area57.6 Ų
Heavy Atom Count27
Formal Charge0
Complexity613
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

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