基本情報
- CAS
90523-31-2- 標準SMILES
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCCNC(=O)c2ccc(N=[N+]=[N-])cc2)C1c1ccccc1C(F)(F)F- InChIKey
SWMHKFTXBOJETC-UHFFFAOYSA-N- 分子式
- C27H26F3N5O5
- 平均分子量
- 557.5 g/mol
- 単同位体質量
- 557.18860343
概要
Azidopine is a member of benzamides.
名称と識別子
- 優先名称
- 3-(2-((4-Azidobenzoyl)amino)ethyl) 5-ethyl 1,4-dihydro-2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-3,5-pyridinedicarboxylate
- IUPAC
- 5-O-[2-[(4-azidobenzoyl)amino]ethyl] 3-O-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
- 現地名
- 1,4-ジヒドロ-2,6-ジメチル-4-[2-(トリフルオロメチル)フェニル]-3,5-ピリジンジカルボン酸3-[2-[(4-アジドベンゾイル)アミノ]エチル]5-エチル
- 英語名
- Azidopine
- 分子式
- C27H26F3N5O5
- 分子量
- 0
名称と別名
Azidopine90523-31-263XR70204A3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-, 2-((4-azidobenzoyl)amino)ethyl ethyl esterO5-[2-[(4-azidobenzoyl)amino]ethyl] O3-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylateO3-(2-((4-azidobenzoyl)amino)ethyl) O5-ethyl 2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3,5-dicarboxylateO3-[2-[(4-azidobenzoyl)amino]ethyl] O5-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylateO5-(2-((4-azidobenzoyl)amino)ethyl) O3-ethyl 2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3,5-dicarboxylateRefChem:9108943-(2-((4-Azidobenzoyl)amino)ethyl) 5-ethyl 1,4-dihydro-2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-3,5-pyridinedicarboxylateNSC6179995-O-[2-[(4-azidobenzoyl)amino]ethyl] 3-O-ethyl 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
名称をさらに表示
物性
構造計算による物性
- XLogP
- 5.7
- 極性表面積
- 108 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 11
- 回転可能結合数
- 11
- 重原子数
- 40
- 形式電荷
- 0
- 複雑度
- 1,070
化学と産業
薬理情報
MeSH Pharmacological Classification
Analogs of those substrates or compounds which bind naturally at the active sites of proteins, enzymes, antibodies, steroids, or physiological receptors. These analogs form a stable covalent bond at the binding site, thereby acting as inhibitors of the proteins or steroids.
サプライヤー3 社
吉林中科研伸科技有限公司18143011203 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
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