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CB 65

CAT: 0931-T41230-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-T41230-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
913534-05-1
Target
Cannabinoid Receptor
Related Pathways
GPCR/G Protein
Purity
0.9953
Bioactivity
CB 65 is a high affinity and selective CB2 receptor agonist with Ki values of 3.3 and > 1000 nM for CB2 and CB1 receptors respectively.
Smiles
C(CN1CCOCC1)N2C=3C(C(=O)C(C(NC4CCCCC4)=O)=C2)=CC=C(Cl)C3
Molecular Formula
C22H28ClN3O3
Molecular Weight
417.93
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

7-chloro-N-cyclohexyl-1-(2-morpholinoethyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CAS Number913534-05-1
PubChem CID16086891
IUPAC Name7-chloro-N-cyclohexyl-1-(2-morpholin-4-ylethyl)-4-oxoquinoline-3-carboxamide
Molecular FormulaC22H28ClN3O3
Molecular Weight417.9
XLogP3.3
Topological Polar Surface Area61.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity629
SMILES
C1CCC(CC1)NC(=O)C2=CN(C3=C(C2=O)C=CC(=C3)Cl)CCN4CCOCC4
InChI
InChI=1S/C22H28ClN3O3/c23-16-6-7-18-20(14-16)26(9-8-25-10-12-29-13-11-25)15-19(21(18)27)22(28)24-17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,24,28)
InChIKey
MFKWLGOHFQBVAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-chloro-N-cyclohexyl-1-(2-morpholinoethyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CAS: 913534-05-1
CID: 16086891
Formula: C22H28ClN3O3
MW: 417.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight417.9
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass417.1819195
Monoisotopic Mass417.1819195
Topological Polar Surface Area61.9 Ų
Heavy Atom Count29
Formal Charge0
Complexity629
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