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25E-NBOMe hydrochloride

CAT: 0013-GTR19241421-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241421-01Size:1 mg
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Description
25E-NBOMe hydrochloride is a potent and selective 5-HT2A receptor agonist, derived from the phenethylamine 2C-E via N- (2-methoxybenzyl) substitution. It is utilized in neuroscience research to study receptor function and signaling in both in vitro and in vivo models.
CAS Number
1539266-39-1
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
Cl.O (C=1C=CC=CC1CNCCC=2C=C (OC) C (=CC2OC) CC) C
Molecular Formula
C20H28ClNO3
Molecular Weight
365.89
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

25E-Nbome hydrochloride
CAS Number1539266-39-1
PubChem CID121230757
IUPAC Name2-(4-ethyl-2,5-dimethoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine;hydrochloride
Molecular FormulaC20H28ClNO3
Molecular Weight365.9
Topological Polar Surface Area39.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count25
Formal Charge0
Complexity339
SMILES
CCC1=CC(=C(C=C1OC)CCNCC2=CC=CC=C2OC)OC.Cl
InChI
InChI=1S/C20H27NO3.ClH/c1-5-15-12-20(24-4)16(13-19(15)23-3)10-11-21-14-17-8-6-7-9-18(17)22-2;/h6-9,12-13,21H,5,10-11,14H2,1-4H3;1H
InChIKey
SSCHHVMAKLDXFM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 25E-Nbome hydrochloride
CAS: 1539266-39-1
CID: 121230757
Formula: C20H28ClNO3
MW: 365.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight365.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass365.1757714
Monoisotopic Mass365.1757714
Topological Polar Surface Area39.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity339
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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