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T-10418

CAT: 0013-GTR19259613-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19259613-02Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
T-10418 is a potent and selective G2A agonist with EC50 of 0.82 μM. T-10418 exhibits higher potency than the reference and natural ligand 9-HODE and high selectivity among G protein-coupled receptors. T-10418 is a suitable candidate for in vivo studies on therapeutic potential of G2A agonism.
CAS Number
1608784-68-4
Purity
0.98
Smiles
O (CC1C=NC=CC=1) C1=CC=CC (=C1) C (N[C@@H] (C (=O) O) CC1C=CC=CC=1) =O
Molecular Formula
C22H20N2O4
Molecular Weight
376.405205726624
Notes
For research use only.

Chemical Information

CID 97259293
CAS Number1608784-68-4
PubChem CID97259293
IUPAC Name(2R)-3-phenyl-2-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]propanoic acid
Molecular FormulaC22H20N2O4
Molecular Weight376.4
XLogP3.2
Topological Polar Surface Area88.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity507
SMILES
C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C2=CC(=CC=C2)OCC3=CN=CC=C3
InChI
InChI=1S/C22H20N2O4/c25-21(24-20(22(26)27)12-16-6-2-1-3-7-16)18-9-4-10-19(13-18)28-15-17-8-5-11-23-14-17/h1-11,13-14,20H,12,15H2,(H,24,25)(H,26,27)/t20-/m1/s1
InChIKey
JGLGMFHQGRAHAO-HXUWFJFHSA-N
Chemical Structure
2D Structure
2D structure of CID 97259293
CAS: 1608784-68-4
CID: 97259293
Formula: C22H20N2O4
MW: 376.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass376.14230712
Monoisotopic Mass376.14230712
Topological Polar Surface Area88.5 Ų
Heavy Atom Count28
Formal Charge0
Complexity507
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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