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Manogepix (E1210)

CAT: 0957-S0491-02Size: 10 mm/ 1 mLDry Ice: NoHazardous: No
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CAT#:0957-S0491-02Size:10 mm/ 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Manogepix (E1210, MGX, APX001A) is a broad-spectrum and orally active antifungal agent that inhibits Gwt1/Gwt1p (GPI-anchored wall transfer protein 1), a protein that plays an important role in fungal cell wall integrity.
CAS Number
936339-60-5
Synonyms
MGX, APX001A
Target
Fungal
Activity
Microbiology
Molecular Formula
C21H18N4O2
Storage Conditions
3 years -20°C powder

Chemical Information

E-1210
CAS Number936339-60-5
PubChem CID16719049
IUPAC Name3-[3-[[4-(pyridin-2-yloxymethyl)phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
Molecular FormulaC21H18N4O2
Molecular Weight358.4
XLogP3.3
Topological Polar Surface Area87.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity444
SMILES
C1=CC=NC(=C1)OCC2=CC=C(C=C2)CC3=NOC(=C3)C4=C(N=CC=C4)N
InChI
InChI=1S/C21H18N4O2/c22-21-18(4-3-11-24-21)19-13-17(25-27-19)12-15-6-8-16(9-7-15)14-26-20-5-1-2-10-23-20/h1-11,13H,12,14H2,(H2,22,24)
InChIKey
WSEKTEUGRLFBSE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of E-1210
CAS: 936339-60-5
CID: 16719049
Formula: C21H18N4O2
MW: 358.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight358.4
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass358.14297583
Monoisotopic Mass358.14297583
Topological Polar Surface Area87.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity444
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