N-(2-{[2-羟基-3-(4-羟基苯氧基)丙基]氨基}乙基)-4-吗啉甲酰胺
[CAS# 69630-22-4]

基本信息

• 产品名称: N-(2-{[2-羟基-3-(4-羟基苯氧基)丙基]氨基}乙基)-4-吗啉甲酰胺
• 英文名: N-(2-{[2-Hydroxy-3-(4-hydroxyphenoxy)propyl]amino}ethyl)-4-morpholinecarboxamide
• 别名: 0.5 Oxalate; bis[N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide] fumarate; Morpholine-4-carboxylic acid {2-[2-hydroxy-3-(4-hydroxy-phenoxy)-propylamino]-ethyl}-amide
• 分子式: C₁₆H₂₅N₃O₅
• 分子量: 339.39
• CAS 登录号: 69630-22-4
• 分子行输入简码 SMILES: C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O
• 国际化学标识码 InChI: 1S/C16H25N3O5/c20-13-1-3-15(4-2-13)24-12-14(21)11-17-5-6-18-16(22)19-7-9-23-10-8-19/h1-4,14,17,20-21H,5-12H2,(H,18,22)
• 国际化学标识检索码 InChIKey: DXPOSRCHIDYWHW-UHFFFAOYSA-N

物理化学性质

• 密度: 1.3±0.1g/cm³ （计算值）
• 沸点: 651.4±55.0°C at 760 mmHg （计算值）
• 闪点: 347.7±31.5°C （计算值）

参考文献

• (1): Zhao YH, Abraham MH, Le J, Hersey A, Luscombe CN, Beck G, Sherborne B, and Cooper I. Rate-limited Steps of Human Oral Absorption and QSAR Studies, Pharm Res., 2002, 19(10), 1446-57
• (2): Jayaprakash Pagadala, Kimberly Williams-Guy, Mohammed M. NoohCurrent address: Department of Biochemistry, Faculty of Pharmacy, Cairo University, Cairo 11562, Egypt, Jena J. Steinle and Duane D. Miller. Beta-adrenergic receptor signaling by the isomers of isoproterenol and like drugs in retinal endothelial cells and Müller cells, Med. Chem. Commun., 2011, 2, 726.