(3S)-3-benzyloxycarbonylamino-1-diaminophosphoryl-2-perhydroazepinone | 307345-56-8

• 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: (3S)-3-benzyloxycarbonylamino-1-diaminophosphoryl-2-perhydroazepinone
• 英文别名: 3(S)-benzyloxycarbonylamino-1-diaminophosphinyl-2-caprolactam；(3S)-3-benzyloxycarbonylamino-1-diaminophosphinyl-2-perhydroazepinone；benzyl N-[(3S)-1-diaminophosphoryl-2-oxoazepan-3-yl]carbamate
• CAS: 307345-56-8
• 化学式: C₁₄H₂₁N₄O₄P
• 分子量: 340.319
• InChiKey: KBXFFFDBYSNNDY-LBPRGKRZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  128
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  (3S)-3-benzyloxycarbonylamino-1-diaminophosphoryl-2-perhydroazepinone 在 钯 氢气 作用下， 以 乙醇 为溶剂， 以97%的产率得到(3S)-3-amino-1-diaminophosphinyl-2-perhydroazepinone
  参考文献：
  名称：

  NOVEL ALPHA-AMINO-N-(DIAMINOPHOSPHINYL)LACTAM DERIVATIVE

  摘要：

  公开号：

  EP1489088B1
• 作为产物：
  描述：

  (S)-3-(Cbz-氨基)-2-氧代氮杂烷 在 正丁基锂 、 三氯氧磷 、 氨 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 3.08h， 以1.55 g的产率得到(3S)-3-benzyloxycarbonylamino-1-diaminophosphoryl-2-perhydroazepinone
  参考文献：
  名称：

  SULPHOSTIN ANALOGUES AND PROCESSES FOR THE PREPARATION OF SULPHOSTIN AND ANALOGUES THEREOF

  摘要：

  公开号：

  EP1184388B1

文献信息

• Novel $g(a)-amino-n-(diaminophosphinyl) lactam derivative
  申请人：Abe Masatoshi

  公开号：US20050164989A1

  公开（公告）日：2005-07-28

  There are disclosed a novel α-amino-N-(diaminophosphinyl)lactam derivative represented by general formula (1): wherein, for example, A is a hydrogen atom or a substituent such as a lower alkyl group or the like; W, X, Y and Z are independently a hydrogen atom or a substituent such as a lower alkyl group, aryl group, arylacyl group, arylaminocarbonyl group or the like; and Q is —(CH 2 ) n — wherein n is 0 to 3, or its salt, and a therapeutic agent and a prophylactic agent for myelosuppression, a therapeutic agent for infectious diseases, an agent for increasing the number of leukocytes and a dipeptidyl peptidase IV inhibitor which comprise the above-mentioned derivative or salt thereof as an active ingredient.

  公开了一种新型α-氨基-N-(二氨基膦基)内酰胺衍生物，其通式表示为(1):其中，例如，A是氢原子或取代基，例如较低的烷基或类似物; W、X、Y和Z分别是氢原子或取代基，例如较低的烷基、芳基、芳基酰基、芳基氨基甲酰基或类似物; Q是—(CH2)n—，其中n为0到3，或其盐，并且包括上述衍生物或其盐作为活性成分的治疗剂和预防剂，用于骨髓抑制、传染病治疗剂、增加白细胞数的剂和二肽基肽酶IV抑制剂。
• Method for preparation of sulphostin and its analogue or intermediates thereof
  申请人：Nagai Masashi

  公开号：US20050020834A1

  公开（公告）日：2005-01-27

  A method for preparing a compound represented by the following general formula (5) where, n is an integer of 0 to 3; and Y represents a protecting group for an amino group, the method including the steps of reacting a compound represented by the following general formula (3) where n and Y are as described above, with a silylating agent, and subsequently reacting it with P (═O) T 3 , where T represents a halogen atom, and further with ammonia. A method for preparing an optically active intermediate of sulphostin or an analogue thereof, which is an optically active amine salt of an optically active compound represented by the following general formula (8) where n is an integer of 0 to 3; Y represents a protecting group for the amino group; and each configuration at C* and P* may be the same or different and indicates S or R, the method including reacting a compound represented by the following general formula (7) where n and Y are as described above; and the configuration of C* indicates either of S or R, with an optically active amine, and resolving the formed diastereomeric salt by fractional crystallization.

  以下是一个制备以下通用式（5）所表示的化合物的方法，其中n为0到3的整数；Y表示氨基保护基。该方法包括以下步骤：将以下通用式（3）所表示的化合物与硅基化试剂反应，然后再与P（═O）T3（其中T表示卤素原子）反应，最后再与氨反应。 以下是制备sulphostin或其类似物的光学活性中间体的方法，该中间体是以下通用式（8）所表示的光学活性化合物的光学活性胺盐，其中n为0到3的整数；Y表示氨基保护基；C*和P*的每个构型可以相同也可以不同，并表示S或R。该方法包括将以下通用式（7）所表示的化合物与光学活性胺反应，并通过分数结晶分离形成的对映异构体盐。
• PROCESSES FOR PREPARATION OF SULPHOSTIN AND ITS ANALOGUES OR INTERMEDIATES THEREOF
  申请人：Nippon Kayaku Kabushiki Kaisha

  公开号：EP1457494A1

  公开（公告）日：2004-09-15

  A method for preparing a compound represented by the following general formula (5)    where, n is an integer of 0 to 3; and Y represents a protecting group for an amino group, the method including the steps of reacting a compound represented by the following general formula (3)    where n and Y are as described above, with a silylating agent, and subsequently reacting it with P (=O) T3, where T represents a halogen atom, and further with ammonia. A method for preparing an optically active intermediate of sulphostin or an analogue thereof, which is an optically active amine salt of an optically active compound represented by the following general formula (8) where n is an integer of 0 to 3; Y represents a protecting group for the amino group; and each configuration at C* and P* may be the same or different and indicates S or R, the method including reacting a compound represented by the following general formula (7) where n and Y are as described above; and the configuration of C* indicates either of S or R, with an optically active amine, and resolving the formed diastereomeric salt by fractional crystallization.

  一种制备由以下通式(5)代表的化合物的方法 其中，n 是 0 至 3 的整数；Y 代表氨基的保护基团，该方法包括以下步骤：使下一通式（3）所代表的化合物与硅烷化剂反应，其中 n 和 Y 如上所述。 其中，n 和 Y 如上所述，与硅烷化剂反应，然后与 P (=O) T3 反应，其中 T 代表卤素原子，再与氨反应。 一种制备舒磷定或其类似物的光学活性中间体的方法，该光学活性中间体是由下 列通式（8）代表的光学活性化合物的光学活性胺盐 其中 n 是 0 至 3 的整数；Y 代表氨基的保护基团；C* 和 P* 的每个构型可以相同或不同，并表示 S 或 R，该方法包括使下式通式（7）所代表的化合物反应 其中 n 和 Y 如上所述；C* 的构型表示 S 或 R，与光学活性胺反应，并通过分馏结晶分 解所形成的非对映异构盐。
• NOVEL ALPHA-AMINO-N-(DIAMINOPHOSPHINYL)LACTAM DERIVATIVE
  申请人：NIPPON KAYAKU KABUSHIKI KAISHA

  公开号：EP1489088B1

  公开（公告）日：2008-08-13
• SULPHOSTIN ANALOGUES AND PROCESSES FOR THE PREPARATION OF SULPHOSTIN AND ANALOGUES THEREOF
  申请人：ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI

  公开号：EP1184388B1

  公开（公告）日：2003-07-30