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AS19

CAT: 0931-T10380-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T10380-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1000578-26-6
Target
5-HT Receptor
Related Pathways
Neuroscience, GPCR/G Protein
Bioactivity
AS19 is a potent, selective 5-HT7 receptor agonist (IC50: 0.83 nM; Ki: 0.6 nM) with demonstrated selectivity for 5-HT7 over 5-HT1A, 5-HT1B, 5-HT1D, and 5-HT5A receptors (Kis: 89.7 nM, 490 nM, 6.6 nM, and 98.5 nM, respectively) .
Smiles
CN(C)[C@H]1CCc2c(C1)cccc2-c1c(C)nn(C)c1C
Molecular Formula
C18H25N3
Molecular Weight
283.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AS-19
CAS Number1000578-26-6
PubChem CID23642275
IUPAC Name(2S)-N,N-dimethyl-5-(1,3,5-trimethylpyrazol-4-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
Molecular FormulaC18H25N3
Molecular Weight283.4
XLogP3.4
Topological Polar Surface Area21.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity356
SMILES
CC1=C(C(=NN1C)C)C2=CC=CC3=C2CC[C@@H](C3)N(C)C
InChI
InChI=1S/C18H25N3/c1-12-18(13(2)21(5)19-12)17-8-6-7-14-11-15(20(3)4)9-10-16(14)17/h6-8,15H,9-11H2,1-5H3/t15-/m0/s1
InChIKey
BTTOYOKCLDAHHO-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of AS-19
CAS: 1000578-26-6
CID: 23642275
Formula: C18H25N3
MW: 283.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight283.4
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass283.204847810
Monoisotopic Mass283.204847810
Topological Polar Surface Area21.1 Ų
Heavy Atom Count21
Formal Charge0
Complexity356
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

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