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Sephin1

CAT: 0931-T21824-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T21824-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13098-73-2
Target
Phosphatase
Related Pathways
Metabolism
Purity
0.998
Bioactivity
Sephin1 (IFB-088) is reportedly a selective inhibitor of GADD34 (PPP1R15A), which is a stress-induced regulatory subunit of protein phosphatase 1 complex that dephosphorylates eIF2α
Smiles
C(=NNC(=N)N)C1=C(Cl)C=CC=C1
Molecular Formula
C8H9ClN4
Molecular Weight
196.64
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Icerguastat

Icerguastat is an organic molecular entity. It has a role as an inhibitor.

CAS Number13098-73-2
PubChem CID9561611
IUPAC Name2-[(E)-(2-chlorophenyl)methylideneamino]guanidine
Molecular FormulaC8H9ClN4
Molecular Weight196.64
XLogP1.1
Topological Polar Surface Area76.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity210
SMILES
C1=CC=C(C(=C1)/C=N/N=C(N)N)Cl
InChI
InChI=1S/C8H9ClN4/c9-7-4-2-1-3-6(7)5-12-13-8(10)11/h1-5H,(H4,10,11,13)/b12-5+
InChIKey
PDWJALXSRRSUHR-LFYBBSHMSA-N
Chemical Structure
2D Structure
2D structure of Icerguastat
CAS: 13098-73-2
CID: 9561611
Formula: C8H9ClN4
MW: 196.64
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight196.64
XLogP31.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass196.0515740
Monoisotopic Mass196.0515740
Topological Polar Surface Area76.8 Ų
Heavy Atom Count13
Formal Charge0
Complexity210
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

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MBS3613145-01Sephin1
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