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Inflachromene

CAT: 0013-GTR19200214-03Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19200214-03Size:1 ml x 10 mM (in DMSO)
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Description
Inflachromene (ICM) is a small molecule inhibitor of HMGB1/2 with anti-inflammatory properties. It has been shown to reduce seizure severity in murine epilepsy models and to inhibit endothelial proliferation and autophagy in vitro via HMGB/TLR4-NF-κB and Beclin 1 pathways, making it a useful research tool for neuroinflammation and autophagy studies.
CAS Number
908568-01-4
Product Name Alternative
HMGB, ICM, Inflachromene
Field of Research
Signal Transduction
Purity
97.36% (May vary between batches)
Solubility
DMSO:80 mg/mL (211.98 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (8.74 mM)
Smiles
CC1 (C) Oc2cc (O) ccc2C2C1=CCn1n2c (=O) n (-c2ccccc2) c1=O
Molecular Formula
C21H19N3O4
Molecular Weight
377.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Inflachromene
CAS Number908568-01-4
PubChem CID49857340
IUPAC Name5-hydroxy-9,9-dimethyl-15-phenyl-8-oxa-13,15,17-triazatetracyclo[8.7.0.02,7.013,17]heptadeca-2(7),3,5,10-tetraene-14,16-dione
Molecular FormulaC21H19N3O4
Molecular Weight377.4
XLogP2.3
Topological Polar Surface Area73.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count28
Formal Charge0
Complexity714
SMILES
CC1(C2=CCN3C(=O)N(C(=O)N3C2C4=C(O1)C=C(C=C4)O)C5=CC=CC=C5)C
InChI
InChI=1S/C21H19N3O4/c1-21(2)16-10-11-22-19(26)23(13-6-4-3-5-7-13)20(27)24(22)18(16)15-9-8-14(25)12-17(15)28-21/h3-10,12,18,25H,11H2,1-2H3
InChIKey
VVOXDJYPDCSQMI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Inflachromene
CAS: 908568-01-4
CID: 49857340
Formula: C21H19N3O4
MW: 377.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight377.4
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass377.13755610
Monoisotopic Mass377.13755610
Topological Polar Surface Area73.3 Ų
Heavy Atom Count28
Formal Charge0
Complexity714
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5773918Inflachromene
A24108-100Inflachromene 100mg
A24108-50Inflachromene 50mg
A24108-10Inflachromene 10mg
A24108-5Inflachromene 5mg

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