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AAZ-A 154 benzoate

CAT: 0931-T200491-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T200491-01Size:25 mg
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CAS Number
2930845-92-2
Target
5-HT Receptor
Related Pathways
GPCR/G Protein, Neuroscience
Bioactivity
AAZ-A 154 benzoate is a selective, competitive, and non-hallucinogenic 5-HT2AR antagonist. This compound facilitates neuronal growth in rodents and produces lasting beneficial behavioral effects.
Smiles
C(O)(=O)C1=CC=CC=C1.C([C@H](N(C)C)C)N1C=2C(=CC(OC)=CC2)C=C1
Molecular Formula
C21H26N2O3
Molecular Weight
354.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AAZ-A 154 (benzoate)
CAS Number2930845-92-2
PubChem CID172652585
IUPAC Namebenzoic acid;(2R)-1-(5-methoxyindol-1-yl)-N,N-dimethylpropan-2-amine
Molecular FormulaC21H26N2O3
Molecular Weight354.4
Topological Polar Surface Area54.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity348
SMILES
C[C@H](CN1C=CC2=C1C=CC(=C2)OC)N(C)C.C1=CC=C(C=C1)C(=O)O
InChI
InChI=1S/C14H20N2O.C7H6O2/c1-11(15(2)3)10-16-8-7-12-9-13(17-4)5-6-14(12)16;8-7(9)6-4-2-1-3-5-6/h5-9,11H,10H2,1-4H3;1-5H,(H,8,9)/t11-;/m1./s1
InChIKey
KTTSHTSGPXGFGT-RFVHGSKJSA-N
Chemical Structure
2D Structure
2D structure of AAZ-A 154 (benzoate)
CAS: 2930845-92-2
CID: 172652585
Formula: C21H26N2O3
MW: 354.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight354.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass354.19434270
Monoisotopic Mass354.19434270
Topological Polar Surface Area54.7 Ų
Heavy Atom Count26
Formal Charge0
Complexity348
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes