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A 1120

CAT: 1410-M23331-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M23331-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A 1120 is a nonretinoid retinol-binding protein 4 (RBP4) antagonist (Ki: 8.3 nM), which disrupts the interaction between RBP4 and its binding partner transthyretin.
CAS Number
1152782-19-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
392.37
Molecular Formula
C20H19F3N2O3
Notes
Research use only, not for human use.
Receptor
RBP4

Chemical Information

2-[({4-[2-(Trifluoromethyl)phenyl]piperidin-1-yl}carbonyl)amino]benzoic acid
CAS Number1152782-19-8
PubChem CID25138295
IUPAC Name2-[[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]amino]benzoic acid
Molecular FormulaC20H19F3N2O3
Molecular Weight392.4
XLogP4.3
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity561
SMILES
C1CN(CCC1C2=CC=CC=C2C(F)(F)F)C(=O)NC3=CC=CC=C3C(=O)O
InChI
InChI=1S/C20H19F3N2O3/c21-20(22,23)16-7-3-1-5-14(16)13-9-11-25(12-10-13)19(28)24-17-8-4-2-6-15(17)18(26)27/h1-8,13H,9-12H2,(H,24,28)(H,26,27)
InChIKey
MEAQCLPMSVEOQF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[({4-[2-(Trifluoromethyl)phenyl]piperidin-1-yl}carbonyl)amino]benzoic acid
CAS: 1152782-19-8
CID: 25138295
Formula: C20H19F3N2O3
MW: 392.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight392.4
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass392.13477696
Monoisotopic Mass392.13477696
Topological Polar Surface Area69.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity561
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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