4-[Bis(2-aminoethyl)amino]4[bis(1,1-dimethylethoxy)phosphinyl]butanoic acid phenylmethyl ester | 345989-88-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-[Bis(2-aminoethyl)amino]4[bis(1,1-dimethylethoxy)phosphinyl]butanoic acid phenylmethyl ester
• 英文别名: Benzyl 4-[bis(2-aminoethyl)amino]-4-[bis[(2-methylpropan-2-yl)oxy]phosphoryl]butanoate；benzyl 4-[bis(2-aminoethyl)amino]-4-[bis[(2-methylpropan-2-yl)oxy]phosphoryl]butanoate
• CAS: 345989-88-0
• 化学式: C₂₃H₄₂N₃O₅P
• 分子量: 471.577
• InChiKey: BHFWDKXZDFDLBX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  32
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  117
• 氢给体数：
  2
• 氢受体数：
  8

文献信息

• CHELATING COMPOUNDS, THEIR COMPLEXES WITH PARAMAGNETIC METALS
  申请人：——

  公开号：US20030013859A1

  公开（公告）日：2003-01-16

  Compounds able to chelate bi- and trivalent paramagnetic metal ions, their chelated complexes with said metal ions and the physiologically compatible salts thereof, as well as the use thereof as contrast agents in the technique known as “Magnetic Resonance Imaging” (M.R.I.).

  能够螯合双价和三价顺磁性金属离子的化合物，所述金属离子的螯合配合物以及生理上相容的盐，以及它们在“磁共振成像”(M.R.I.)技术中作为对比剂的使用。
• CHELATING COMPOUNDS AND THEIR COMPLEXES WITH PARAMAGNETIC METALS
  申请人：BRACCO S.p.A.

  公开号：EP1155023A1

  公开（公告）日：2001-11-21
• US6509324B1
  申请人：——

  公开号：US6509324B1

  公开（公告）日：2003-01-21
• [EN] CHELATING COMPOUNDS, THEIR COMPLEXES WITH PARAMAGNETIC METALS<br/>[FR] COMPOSES CHELATANTS, LEURS COMPLEXES AVEC DES METAUX PARAMAGNETIQUES
  申请人：BRACCO SPA

  公开号：WO2001046207A1

  公开（公告）日：2001-06-28

  Compounds able to chelate bi- and trivalent paramagnetic metal ions, their chelated complexes with said metal ions and the physiologically compatible salts thereof, as well as the use thereof as contrast agents in the technique known as 'Magnetic Resonance Imaging' (M.R.I.).