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SAE-14

CAT: 0931-T9975-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T9975-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1241280-25-0
Target
Others, EBI2/GPR183
Related Pathways
Others, GPCR/G Protein
Purity
0.9985
Bioactivity
SAE-14 is a specific GPR183 antagonist. SAE-14 inhibits GPR183 with an IC50 of 28.5 nM in a calcium mobilization assay[1].
Smiles
Fc1cc(NC(=O)CCc2ccc(F)c(F)c2)cc(c1)N1CCOCC1
Molecular Formula
C19H19F3N2O2
Molecular Weight
364.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,4-Difluoro-N-[3-fluoro-5-(4-morpholinyl)phenyl]benzenepropanamide
CAS Number1241280-25-0
PubChem CID47088557
IUPAC Name3-(3,4-difluorophenyl)-N-(3-fluoro-5-morpholin-4-ylphenyl)propanamide
Molecular FormulaC19H19F3N2O2
Molecular Weight364.4
XLogP3
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity462
SMILES
C1COCCN1C2=CC(=CC(=C2)NC(=O)CCC3=CC(=C(C=C3)F)F)F
InChI
InChI=1S/C19H19F3N2O2/c20-14-10-15(12-16(11-14)24-5-7-26-8-6-24)23-19(25)4-2-13-1-3-17(21)18(22)9-13/h1,3,9-12H,2,4-8H2,(H,23,25)
InChIKey
SIVJKYRAPQKLIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4-Difluoro-N-[3-fluoro-5-(4-morpholinyl)phenyl]benzenepropanamide
CAS: 1241280-25-0
CID: 47088557
Formula: C19H19F3N2O2
MW: 364.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.4
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass364.13986234
Monoisotopic Mass364.13986234
Topological Polar Surface Area41.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity462
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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