(2S)-2-[[4-[(2-amino-5-formyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-methylbenzenesulfonic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 蝶啶及其衍生物
• 英文名称: (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-methylbenzenesulfonic acid
• 化学式: C48H47ClF3N11O13S
• 分子量: 1110.5
• InChiKey: AWPHUFLJGWULEV-QGKNRDCFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.06
• 重原子数：
  77
• 可旋转键数：
  15
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  371
• 氢给体数：
  11
• 氢受体数：
  19

文献信息

• [EN] BIOCOMPATIBLE POLYMER COMPOSITIONS FOR TISSUE VOID FILLING<br/>[FR] COMPOSITIONS POLYMÈRES BIOCOMPATIBLES POUR REMPLISSAGE DE VIDE TISSULAIRE
  申请人：UNIV RUTGERS

  公开号：WO2014116716A1

  公开（公告）日：2014-07-31

  Biodegradable, bioabsorhahie cross-linked polymer tissue scaffolds for filling a void in human or animal soft tissue, such as a surgical or other wound, are disclosed. Drugs incorporated into the polymer backbone and/or loaded into the matrix are released directly to the target site. Additional non-toxic chemical constituents can be used to tune the hydrophilio hydrophobic and other physical properties of the cross-linked polymer tissue scaffolds, and incorporating brominated or iodinated constituents provides radio-opacity. The radio-opaque cross-linked polymer tissue scaffolds can assist in the targeting of radiation therapy.