Products for Research Use Only

IMD-1622

CAT: 0013-GTR19211393-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211393-02Size:50 mg
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Description
IMD-1622 is a small molecule inhibitor targeting plasminogen activator inhibitor-1 (PAI-1) . It is a research tool used in vitro and in vivo to study fibrinolysis, thrombosis, and fibrosis-related pathways.
CAS Number
848601-97-8
Smiles
C (N1C (=O) C (=CC2=CC (O) =C (O) C (O) =C2) SC1=O) C3=CC (Cl) =C (Cl) C=C3
Molecular Formula
C17H11Cl2NO5S
Molecular Weight
412.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Imd-1622
CAS Number848601-97-8
PubChem CID23125181
IUPAC Name(5Z)-3-[(3,4-dichlorophenyl)methyl]-5-[(3,4,5-trihydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Molecular FormulaC17H11Cl2NO5S
Molecular Weight412.2
XLogP4.1
Topological Polar Surface Area123
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity592
SMILES
C1=CC(=C(C=C1CN2C(=O)/C(=C/C3=CC(=C(C(=C3)O)O)O)/SC2=O)Cl)Cl
InChI
InChI=1S/C17H11Cl2NO5S/c18-10-2-1-8(3-11(10)19)7-20-16(24)14(26-17(20)25)6-9-4-12(21)15(23)13(22)5-9/h1-6,21-23H,7H2/b14-6-
InChIKey
LOGYYEXKVXHOIW-NSIKDUERSA-N
Chemical Structure
2D Structure
2D structure of Imd-1622
CAS: 848601-97-8
CID: 23125181
Formula: C17H11Cl2NO5S
MW: 412.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight412.2
XLogP34.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass410.9734990
Monoisotopic Mass410.9734990
Topological Polar Surface Area123 Ų
Heavy Atom Count26
Formal Charge0
Complexity592
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes