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Chemical structure of JWH 018 N-(2-methylbutyl) isomer

GC41022

JWH 018 N-(2-methylbutyl) isomer

Also known as [1-(2-methylbutyl)indol-3-yl]-naphthalen-1-ylmethanone

JWH 018 2-methylbutyl homolog is an analog of JWH 018, a mildly selective agonist of the central cannabinoid receptor (Ki = 8·9 nM) derived from the aminoalkylindole WIN 55,212-2

ChemicalCAS1427325-50-5MW341.5FormulaC24H23NO
CAS number
1427325-50-5
Molecular weight
341.5
Formula
C24H23NO
Solubility
DMF： 20 mg/ml,DMSO： 10 mg/ml,Ethanol： 20 mg/ml
InChIKey
VPSRJWNBSBKXAR-UHFFFAOYSA-N
Catalogue number
GC41022
Brand
GLPBIO
Computed properties PubChem CID 53394764 · XLogP 6.2 · TPSA 22 Ų · H-bond donors 0
XLogP
6.2
TPSA
22 Ų
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
26

SMILES CCC(C)CN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43

Computed descriptors from PubChem (CID 53394764), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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