JWH 018 N-(3-methylbutyl) isomer
Basic information
- CAS
1346604-93-0- Standard SMILES
CC(C)CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21- InChIKey
BBNUROBSKAJPGN-UHFFFAOYSA-N- Molecular formula
- C24H23NO
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.17796436
Overview
JWH-018 N-(3-methylbutyl) isomer is an indolecarboxamide.
Names & identifiers
- Preferred name
- JWH 018 N-(3-methylbutyl) isomer
- IUPAC
- [1-(3-methylbutyl)indol-3-yl]-naphthalen-1-ylmethanone
- English name
- JWH 018 N-(3-methylbutyl) isomer
- Molecular formula
- C24H23NO
- Molecular weight
- 341.45
Names & synonyms
1346604-93-0JWH 018 N-(3-methylbutyl) isomerN-Isopentyl-3-(1-naphthoyl)indole (JWH 018 isomer)[1-(3-methylbutyl)indol-3-yl]-naphthalen-1-ylmethanoneJWH-018 N-3-MethylbutylCHEBI:183709DTXSID201017298WDC60493JWH-018 N-(3-methylbutyl) isomerCCG-208741NS00097833(1-isopentylindol-3-yl)-(1-naphthyl)methanone
Show more names
Methanone, [1-(3-methylbutyl)-1H-indol-3-yl]-1-naphthalenyl-
[1-(3-methylbutyl)-1H-indol-3-yl](naphthalen-1-yl)methanone
Database identifiers
- CAS
1346604-93-0- PubChem CID
- 53394752
- DTXSID
DTXSID201017298- ChEBI
CHEBI:183709- Nikkaji
- J3.226.295C
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 487
Physicochemical properties
- solubility
- 20 mg/ml; · DMF: 20 mg/ml; DMSO: 10 mg/ml; Ethanol: 20 mg/ml
- Symbol(GHS)
- 2 · GHS02,GHS08
- Signal word
- Danger
- Hazard statements
- 225 · H225-H370
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P260-P264-P270-P280-P303+P361+P353-P307+P311-P321-P370+P378-P403+P235-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS08
- Hazard statements
- H225-H370
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P260-P264-P270-P280-P303+P361+P353-P307+P311-P321-P370+P378-P403+P235-P405-P501
Chemistry & industry
Applications
UsesThe 3-methylbutyl homolog of JWH 073 (B693550). An analgesic compound which acts as a partial agonist at both the CB1 and CB2 cannabinoid receptors.
Additional notes
DefinitionChEBI: JWH-018 N-(3-methylbutyl) isomer is an indolecarboxamide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…