2-(diethylamino)-N-(2,4,6-trimethylphenyl)acetamide hydrochloride

• ChemBase编号: 179170
• 分子式: C15H25ClN2O
• 平均质量: 284.8248
• 单一同位素质量: 284.16554111
• SMILES: c1c(cc(c(c1C)NC(=O)CN(CC)CC)C)C.Cl
• Canonical SMILES: CCN(CC(=O)Nc1c(C)cc(cc1C)C)CC.Cl
• InChI: InChI=1S/C15H24N2O.ClH/c1-6-17(7-2)10-14(18)16-15-12(4)8-11(3)9-13(15)5;/h8-9H,6-7,10H2,1-5H3,(H,16,18);1H
• InChIKey: KOOGJYYOMPUGCW-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-(diethylamino)-N-(2,4,6-trimethylphenyl)acetamide hydrochloride
• IUPAC传统名: trimecaine hydrochloride
• 别名: Mesocain; Mesocaine; Trimekain Hydrochloride; Trimecaine Hydrochloride; 2-(Diethylamino)-N-(2,4,6-trimethylphenyl)acetamide Hydrochloride; 2-(Diethylamino)-2',4',6'-trimethylacetanilide Monohydrochloride; 2-(Diethylamino)-N-mesitylacetamide hydrochloride

登记号

• CAS号: 1027-14-1
• MDL号: MFCD00425887
• PubChem SID: 164235080
• PubChem CID: 2843496

理论计算性质

• Acid pKa: 14.146161
• 质子受体: 2
• 质子供体: 1
• LogD (pH = 5.5): 1.1045275
• LogD (pH = 7.4): 2.8291805
• Log P: 3.3563347
• 摩尔折射率: 78.9708 cm^3
• 极化性: 29.407034 Å^3
• 极化表面积: 32.34 Å^2
• 可自由旋转的化学键: 5
• 里宾斯基五规则: true

分子性质

产品相关信息

• 纯度: 95+%

详细说明

Toronto Research Chemicals - T795620

A local anesthetic and cardial antiarrhythmic. It used in epidural postoperative analgesia after major urological procedures in combination with morphine.

参考文献

• Dostalova, V. et al.: Bratisl. Lek. Listy, 109, 11 (2008)
• Gendenshtein, E.I. et al.: Kardiol., 16, 128 (2008)
• Stolc, S. et al.: Eur. J. Pharmacol., 164, 249 (2008)