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AF38469

CAT: 0013-GTR19166307-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19166307-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
AF38469
CAS Number
1531634-31-7
Product Name Alternative
AF38469, AF-38469, AF 38469, Inhibitor, inhibit, NeurotensinReceptor, Neurotensin Receptor, Sortilin
Field of Research
Pharmacology & Drug Discovery
Purity
99.18% (May vary between batches)
Solubility
10% DMSO+90% Corn Oil:2 mg/mL (6.17 mM) ; DMSO:40 mg/mL (123.36 mM)
Smiles
Cc1cccc (NC (=O) c2ccc (cc2C (O) =O) C (F) (F) F) n1
Molecular Formula
C15H11F3N2O3
Molecular Weight
324.25
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

2-((6-Methylpyridin-2-yl)carbamoyl)-5-(trifluoromethyl)benzoic acid
CAS Number1531634-31-7
PubChem CID72706115
IUPAC Name2-[(6-methyl-2-pyridinyl)carbamoyl]-5-(trifluoromethyl)benzoic acid
Molecular FormulaC15H11F3N2O3
Molecular Weight324.25
XLogP2.8
Topological Polar Surface Area79.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity456
SMILES
CC1=NC(=CC=C1)NC(=O)C2=C(C=C(C=C2)C(F)(F)F)C(=O)O
InChI
InChI=1S/C15H11F3N2O3/c1-8-3-2-4-12(19-8)20-13(21)10-6-5-9(15(16,17)18)7-11(10)14(22)23/h2-7H,1H3,(H,22,23)(H,19,20,21)
InChIKey
JWCUSQCZMQIBMR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((6-Methylpyridin-2-yl)carbamoyl)-5-(trifluoromethyl)benzoic acid
CAS: 1531634-31-7
CID: 72706115
Formula: C15H11F3N2O3
MW: 324.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.25
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass324.07217670
Monoisotopic Mass324.07217670
Topological Polar Surface Area79.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity456
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

Alternative Products

CatalogName
GLC63431-01AF38469

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