N-(2-ナフチル)-L-ロイシンアミド

Leucine-beta-naphthylamide

HCID 102475CAS 732-85-4

基本情報

標準SMILES: CC(C)C[C@H](N)C(=O)Nc1ccc2ccccc2c1
InChIKey: JWHURRLUBVMKOT-HNNXBMFYSA-N
分子式: C16H20N2O
平均分子量: 256.34 g/mol
単同位体質量: 256.15756326

概要

L-leucine 2-naphthylamide is an L-leucine derivative that is the amide obtained by formal condensation of the carboxy group of L-leucine with the amino group of 2-naphthylamine. It has a role as a chromogenic compound. It is an amino acid amide, a L-leucine derivative and a N-(2-naphthyl)carboxamide.

名称と識別子

優先名称: Leucine-beta-naphthylamide
IUPAC: (2S)-2-amino-4-methyl-N-naphthalen-2-ylpentanamide
現地名: N-(2-ナフチル)-L-ロイシンアミド
英語名: L-Leucine beta-naphthylamide
分子式: C16H20N2O
分子量: 256.34

名称と別名

732-85-4Leucine-beta-naphthylamideleucine-2-naphthylamideLeu-NapPentanamide, 2-amino-4-methyl-N-2-naphthalenyl-, (S)-RefChem:153063211-990-0L-Leucine beta-naphthylamideH-Leu-bNA(S)-2-Amino-4-methyl-N-(naphthalen-2-yl)pentanamideN-(2-Naphthyl)-L-leucinamideH-Leu-betaNA

名称をさらに表示

(S)-2-アミノ-4-メチル-N-(2-ナフチル)バレルアミドL-ロイシンβ-ナフチルアミドLeu-β-ナフチルアミド(S)-2-アミノ-4-メチル-N-(2-ナフタレニル)ペンタンアミドL-Leu-2-ナフチル-NH2N-(2-ナフチル)-L-ロイシンアミドH-LEU-ΒNAL-ロイシン Β-ナフチルアミド(2S)-2-アミノ-4-メチル-N-(ナフタレン-2-イル)ペンタンアミドH-Leu-βNAL-Leu-NNapLEUCINE-BETANAEinecs 211-990-0Leu-β-naphthylamidel-leucine β-naphthylamideL-LEUCINE-2-NAPHTHYLAMIDE

L-leucine 2-naphthylamideL-Leucine-beta-naphthylamide(2S)-2-amino-4-methyl-N-naphthalen-2-ylpentanamide(S)-2-Amino-4-methyl-N-2-naphthylvaleramideL-?Leucine-??-?naphthylamide2-Amino-4-methyl-N-(2-naphthyl)pentanamiden-naphthalen-2-yl-l-leucinamideL-Leucine-|A-naphthylamide

データベース識別子

CAS: 732-85-4
PubChem CID: 102475
DTXSID: DTXSID20993920
ChEMBL: CHEMBL22905
ChEBI: CHEBI:90476
EC Number: 211-990-0
Nikkaji: J193.101F

物性

構造計算による物性

XLogP: 3.2
極性表面積: 55.1 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 4
重原子数: 19
形式電荷: 0
複雑度: 303

物理化学的性質

貯蔵温度: -20 °C · -20°C
溶解性: 2 O: · H2O: 不溶
外見: powder
水溶解度: 2 O: · H2O: insoluble
InChI: 1S/C16H20N2O/c1-11(2)9-15(17)16(19)18-14-8-7-12-5-3-4-6-13(12)10-14/h3-8,10-11,15H,9,17H2,1-2H3,(H,18,19)/t15-/m0/s1
InChIKey: JWHURRLUBVMKOT-HNNXBMFYSA-N
SMILES: CC(C)C[C@H](N)C(=O)Nc1ccc2ccccc2c1

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H351 (97.5%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesCarc. 2 (97.5%)

安全データ

wgk: 3
hs_code: 29242990
risk_code: 40
hazard_code: Xn
safety_code: 22-36
Hazard Classifications: Carc. 2
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野

使用L-Leucine-β-naphthylamide is used in the synthesis of protein tyrosine phosphatase inhibitors. Used as an agent to combat Leishmania major.

サプライヤー19 社

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補足説明

定義ChEBI: An L-leucine derivative that is the amide obtained by formal condensation of the carboxy group of L-leucine with the amino group of 2-naphthylamine.