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Adomeglivant

CAT: 1568-C07249-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C07249-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1488363-78-5
Synonyms
LY2409021
SKU
C07249-5mg
Target
Glucagon Receptor
Applications
GPCR & G Protein
Smiles
CC1=CC (=CC (=C1C2=CC=C (C=C2) C (C) (C) C) C) OC (CCC (F) (F) F) C3=CC=C (C=C3) C (=O) NCCC (=O) O
Molecular Formula
C32H36F3NO4
Additionnal Information
Adomeglivant (LY2409021) is a potent and selective antagonist of glucagon receptor that is used as a chronic treatment for type 2 diabetes.
Storage Conditions
3 years -20°C powder

Chemical Information

Adomeglivant

Adomeglivant has been investigated for the basic science of Type 2 Diabetes.

CAS Number1488363-78-5
PubChem CID91933867
IUPAC Name3-[[4-[(1S)-1-[4-(4-tert-butylphenyl)-3,5-dimethylphenoxy]-4,4,4-trifluorobutyl]benzoyl]amino]propanoic acid
Molecular FormulaC32H36F3NO4
Molecular Weight555.6
XLogP8.1
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Heavy Atom Count40
Formal Charge0
Complexity798
SMILES
CC1=CC(=CC(=C1C2=CC=C(C=C2)C(C)(C)C)C)O[C@@H](CCC(F)(F)F)C3=CC=C(C=C3)C(=O)NCCC(=O)O
InChI
InChI=1S/C32H36F3NO4/c1-20-18-26(19-21(2)29(20)23-10-12-25(13-11-23)31(3,4)5)40-27(14-16-32(33,34)35)22-6-8-24(9-7-22)30(39)36-17-15-28(37)38/h6-13,18-19,27H,14-17H2,1-5H3,(H,36,39)(H,37,38)/t27-/m0/s1
InChIKey
FASLTMSUPQDLIB-MHZLTWQESA-N
Chemical Structure
2D Structure
2D structure of Adomeglivant
CAS: 1488363-78-5
CID: 91933867
Formula: C32H36F3NO4
MW: 555.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight555.6
XLogP38.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Exact Mass555.25964312
Monoisotopic Mass555.25964312
Topological Polar Surface Area75.6 Ų
Heavy Atom Count40
Formal Charge0
Complexity798
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