基本情報
- CAS
335161-24-5- 標準SMILES
O=C(c1cccc2ccccc12)c1cn(CCCCCF)c2ccccc12- InChIKey
ALQFAGFPQCBPED-UHFFFAOYSA-N- 分子式
- C24H22FNO
- 平均分子量
- 359.4 g/mol
- 単同位体質量
- 359.16854249
概要
AM2201 is an indolecarboxamide.
名称と識別子
- 優先名称
- AM 2201
- IUPAC
- [1-(5-fluoropentyl)indol-3-yl]-naphthalen-1-ylmethanone
- 現地名
- AM-2201
- 英語名
- AM2201
- 分子式
- C24H22FNO
- 分子量
- 359.44
名称と別名
335161-24-5AM-2201AM2201AM 2201TBJ0966F1ODEA No. 7201[1-(5-fluoropentyl)indol-3-yl]-naphthalen-1-ylmethanoneJ2.973.653GDTXSID50187158JWH-2201(1-(5-fluoropentyl)indol-3-yl)-naphthalen-1-ylmethanoneRefChem:111792
名称をさらに表示
1-(5-フルオロペンチル)-3-(ナフタレン-1-イルカルボニル)-1H-インドール1-(5-フルオロペンチル)-1H-インドール-3-イル(1-ナフチル)ケトン1-(5-フルオロペンチル)-1H-インドール-3-イル(1-ナフチル)メタノン1-(5-フルオロペンチル)-3-(ナフタレン-1-カルボニル)-1H-インドール[1-(5-fluoropentyl)-1H-indole-3-yl](naphthalene-1-yl)methanoneAM2201 (CRM)AM-2201 (AM 2201AM2201 (exempt preparation)AM-2201, 1mg/ml in MethanolAM-2201, 0.1mg/ml in Methanol1-(5-fluoropentyl)-3-(naphtalen-1-oy)indole
DTXCID60109649(1-(5-Fluoropentyl)-1H-indol-3-yl)(naphthalen-1-yl)methanone[1-(5-Fluoropentyl)-1H-indol-3-yl]-1-naphthalenylmethanone1-(5-fluoropentyl)-3-(1-naphthoyl)indoleCHEMBL3526578[1-(5-Fluoropentyl)-1H-indol-3-yl](naphthalen-1-yl)methanoneMethanone,[1-(5-fluoropentyl)-1H-indol-3-yl]-1-naphthalenyl-AM-2201 (1.0 mg/ml in Methanol)
データベース識別子
物性
構造計算による物性
- XLogP
- 5.9
- 極性表面積
- 22 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 2
- 回転可能結合数
- 7
- 重原子数
- 27
- 形式電荷
- 0
- 複雑度
- 495
実験および物理化学的性質
Drugs
DEA NFLIS-Drug Category -> Synthetic Cannabinoids
DEA Schedule I Controlled Substance -> Hallucinogenic substances
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Synthetic Cannabinoids
Collision Cross Section187.4 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated]
物理化学的性質
- 沸点
- 551.1 · 551.1±30.0 °C(Predicted)
- 比重(密度)
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- 貯蔵温度
- -10 to · -10 to -25°C
- 溶解性
- 2 mg/mL, · DMSO: 2mg/mL, clear
- 外見
- powder
- 色
- white to beige
- InChI
- 1S/C24H22FNO/c25-15-6-1-7-16-26-17-22(20-12-4-5-14-23(20)26)24(27)21-13-8-10-18-9-2-3-11-19(18)21/h2-5,8-14,17H,1,6-7,15-16H2
- InChIKey
- ALQFAGFPQCBPED-UHFFFAOYSA-N
- SMILES
- O=C(C1=CC=CC2=C1C=CC=C2)C3=CN(C4=CC=CC=C43)CCCCCF
化学的性質
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P270, P271, P301+P316, P304+P340, P316, P319, P321, P330, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationDEA schedule I controlled substance
Hazard Classes and CategoriesAcute Tox. 3 (50%)
安全データ
- wgk
- WGK 3
- Hazard Classifications
- STOT SE 3
- ストレージクラス
- 11 - Combustible Solids
- DEA Controlled Substances
- CSCN: 7201CSA SCH: Schedule INARC: No
化学と産業
応用分野
説明AM2201 (Item No. 10707) is an analytical reference material characterized as a synthetic cannabinoid. AM2201 is regulated as a Schedule I compound in the United States. This product is intended for research and forensic applications.
使用AM2201 is a potent synthetic cannabinoid (CB) with Ki values of 1.0 and 2.6 nM for the CB1 and CB2 receptors, respectively. The physiological actions and metabolism of AM2201 have not been characterized. This product is a qualified Reference Material (RM) that has been manufactured and tested to meet ISO17025 and Guide 34 guidelines. These materials are tested using validated analytical methods on qualified instrumentation to ensure traceability of measurements. All traceable RMs may be distinguished by their CofAs and can be downloaded below using the batch number located on the product label. For a representative CofA please contact our technical support.[Cayman Chemical]
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