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AZD7687

CAT: 0607-A3215-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-A3215-5Size:5 mg
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Description
DGAT inhibitor,potent and selective
CAS Number
1166827-44-6
Product Name Alternative
2-[4-[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl]acetic acid
Sequence
AZD 7687; AZD-7687
Field of Research
Metabolism DGAT
Purity
0.98
Solubility
Soluble in DMSO
Smiles
CC1=C(N=C(C(=N1)C)C(=O)N)C2=CC=C(C=C2)C3CCC(CC3)CC(=O)O
Molecular Formula
C21H25N3O3
Molecular Weight
367.44
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

{4-[4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl}acetic acid

AZD-7687 is under investigation in clinical trial NCT01119352 (AZD7687 Multiple Ascending Dose Study).

CAS Number1166827-44-6
PubChem CID42636350
IUPAC Name2-[4-[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl]acetic acid
Molecular FormulaC21H25N3O3
Molecular Weight367.4
XLogP3.2
Topological Polar Surface Area106
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity525
SMILES
CC1=C(N=C(C(=N1)C)C(=O)N)C2=CC=C(C=C2)C3CCC(CC3)CC(=O)O
InChI
InChI=1S/C21H25N3O3/c1-12-19(24-20(21(22)27)13(2)23-12)17-9-7-16(8-10-17)15-5-3-14(4-6-15)11-18(25)26/h7-10,14-15H,3-6,11H2,1-2H3,(H2,22,27)(H,25,26)
InChIKey
YXFNPRHZMOGREC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of {4-[4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl}acetic acid
CAS: 1166827-44-6
CID: 42636350
Formula: C21H25N3O3
MW: 367.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight367.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass367.18959167
Monoisotopic Mass367.18959167
Topological Polar Surface Area106 Ų
Heavy Atom Count27
Formal Charge0
Complexity525
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