N1-azepane biguanide hydrochloride | 7279-23-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氮杂环庚烷
• 英文名称: N1-azepane biguanide hydrochloride
• 英文别名: (hexahydro-azepine-1-carboximidoyl)-guanidine; hydrochloride；(Hexahydro-azepin-1-carbimidoyl)-guanidin; Hydrochlorid；N-(diaminomethylidene)azepane-1-carboximidamide;hydrochloride
• CAS: 7279-23-4
• 化学式: C₈H₁₇N₅*ClH
• 分子量: 219.717
• InChiKey: FMCMIXZVPKJUMB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.49
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  91.5
• 氢给体数：
  4
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  黄莲素 、 二聚氰胺 生成 N1-azepane biguanide hydrochloride
  参考文献：
  名称：

  Shapiro et al., Journal of the Chemical Society, 1959, vol. 81, p. 3728,3830,3732

  摘要：

  DOI：

文献信息

• ANTIBACTERIAL HYDROPHILIC COMPOUND AND USE THEREOF
  申请人：SHENZHEN UNIVERSITY

  公开号：US20200093124A1

  公开（公告）日：2020-03-26

  The present disclosure provides an antibacterial hydrophilic compound. The antibacterial hydrophilic compound may react, induced by light through a hydrogen abstraction group in the structural formula thereof, with a C—H group and thus bind to a surface of a material having the C—H group (for example, chemical fibers such as polyester, chinlon, and the like; plastics, rubbers, and other similar materials), which can impart a durable antibacterial activity and hydrophilicity to the material. The antibacterial hydrophilic compound has a relatively strong binding force to the surface of the material without damaging the mechanical properties of the raw material. The present disclosure also provides a modified material that is modified by the antibacterial hydrophilic compound.

  本公开提供一种抗菌亲水化合物。该抗菌亲水化合物可以通过其结构式中的氢抽取基团受光诱导反应，与C—H基团发生作用，从而结合到具有C—H基团的材料表面（例如，化学纤维如涤纶、尼龙等；塑料、橡胶和其他类似材料），从而赋予材料耐久的抗菌活性和亲水性。该抗菌亲水化合物对材料表面具有相对较强的结合力，而不会损害原材料的机械性能。本公开还提供一种由该抗菌亲水化合物改性的材料。
• Silver dihydrogen citrate compositions
  申请人：Arata B. Andrew

  公开号：US20060051430A1

  公开（公告）日：2006-03-09

  Personal care and home care compositions are disclosed, which include silver dihydrogen citrate. The inventive compositions advantageously take the form of suspensions, pastes, liquids and gels. The inventive compositions also optionally comprise additional ingredients, and are therefore suitable for a wide variety of personal, home and industrial care purposes.

  护理和家居用品组合物被披露，其中包括柠檬酸二氢银。这种创新的组合物有利地采用悬浮液、糊状物、液体和凝胶的形式。这些创新的组合物还可以选择性地包含额外的成分，因此适用于各种个人、家庭和工业护理用途。
• Use of phenylethylamine derivatives for the antimicrobial treatment of surfaces
  申请人：——

  公开号：US20030207884A1

  公开（公告）日：2003-11-06

  The use of compounds of formula (1) is described, in which compounds R 1 , R 2 and R 3 are each independently of the others hydrogen; C 1 -C 20 alkyl; C 3 -C 7 cycloalkyl; C 2 -C 20 alkenyl; C 4 -C 7 cycloalkenyl; C 2 -C 20 alkynyl, C 4 -C 7 cycloalkynyl; or unsubstituted or C 1 -C 5 alkyl-, C 3 -C 7 cylcoalkyl-, C 1 -C 5 alkoxyl-, C 3 -C 7 cycloakoxy-, halo-, oxo-, carboxy-, carboxy-C 1 -C 7 alkyl ester-, carboxy-C 3 -C 7 cylcloalkyl ester-, cyano-, trifluoromethyl-, pentafluoroethyl-, amino-, N,N-mono- or di-C 1 -C 20 alkylamino- or nitro-substituted phenyl-C 1 -C 5 alkyl, naphthyl-C 1 -C 5 alkyl, phenylcarbonyl-C 1 -C 5 alkyl, naphthylcarbonyl-C 1 -C 5 alkyl, pyrrolylalkyl, furanylalkyl, thiophenylalkyl, pyrazolylalkyl, imidazolylalkyl, oxazolylalkyl, thiazolylalkyl, isoxazolylalkyl, isothiazolylalkyl, 1,2,3-triazolylalkyl, 1,2,4-triazolylalkyl, 1,2,3-oxadiazolylalkyl, 1,3,4-oxadiazolylalkyl, 1,2,3-thiadiazolylalkyl, 1,3,4-thiadiazolylalkyl, indolylalkyl, pyridylalkyl, pyridazinylalkyl, pyrimidinylalkyl, pyridazinylalkyl, quinolinylalkyl, isoquinolinylalkyl, pyrrolyl, furanyl, thiophenyl, pyrazolyl, imidazolyl, oxazolyl, thiazolyl, isoxazolyl, isothiazolyl, 1,2,3-triazolyl, 1,2,4-triazolyl, 1,2,3-oxadiazolyl, 1,3,4-oxadiazolyl, 1,2,3-thiadiazolyl, 1,3,4-thiadiazolyl, indolyl, pyridyl, pyridazinyl, pyrimidinyl, pyridazinyl, quinolinyl or isoquinolinyl; R 4 , R 5 , R 6 and R 7 are each independently of the others hydrogen; C 1 -C 20 alkyl; C 3 -C 7 cycloalky; C 2 -C 20 alkenyl; C 4 -C 7 cycloalkenyl; C 2 -C 20 alkynyl; or C 4 -C 7 cycloalkynyl; and m and n are each independently of the other 0 or 1, for antimicrobial treatment of surfaces. The compounds exhibit a pronounced activity against pathogenic gram-positive and gram-negative bacteria, and also against yeasts and moulds. They are accordingly suitable for the antimicrobial treatment, especially preservation and disinfection, of surfaces.

  描述了化合物的使用，其中化合物R1、R2和R3分别独立地是氢；C1-C20烷基；C3-C7环烷基；C2-C20烯基；C4-C7环烯基；C2-C20炔基，C4-C7环炔基；或未取代或C1-C5烷基，C3-C7环烷基，C1-C5烷氧基，C3-C7环烷氧基，卤素，酮基，羧基，羧基-C1-C7烷酯基，羧基-C3-C7环烷基酯基，氰基，三氟甲基，五氟乙基，氨基，N，N-单或二-C1-C20烷基氨基或硝基取代的苯基-C1-C5烷基，萘基-C1-C5烷基，苯基羰基-C1-C5烷基，萘基羰基-C1-C5烷基，吡咯基烷基，呋喃基烷基，噻吩基烷基，吡唑基烷基，咪唑基烷基，噁唑基烷基，噻唑基烷基，异噁唑基烷基，异噻唑基烷基，1,2,3-三唑基烷基，1,2,4-三唑基烷基，1,2,3-噁二唑基烷基，1,3,4-噁二唑基烷基，1,2,3-噻二唑基烷基，1,3,4-噻二唑基烷基，吲哚基烷基，吡啶基烷基，吡啶并咪唑基烷基，嘧啶基烷基，吡啶并嘧啶基烷基，喹啉基烷基，异喹啉基烷基，吡咯基，呋喃基，噻吩基，吡唑基，咪唑基，噁唑基，噻唑基，异噁唑基，异噻唑基，1,2,3-三唑基，1,2,4-三唑基，1,2,3-噁二唑基，1,3,4-噁二唑基，1,2,3-噻二唑基，1,3,4-噻二唑基，吲哚基，吡啶基，吡啶并咪唑基，嘧啶基，吡啶并嘧啶基，喹啉基，异喹啉基；R4、R5、R6和R7分别独立地是氢；C1-C20烷基；C3-C7环烷基；C2-C20烯基；C4-C7环烯基；C2-C20炔基；或C4-C7环炔基；m和n分别独立地是0或1，用于对抗菌处理表面。这些化合物对致病的革兰氏阳性和阴性细菌，以及酵母和霉菌表现出显著的活性。因此，它们适用于对表面进行抗菌处理，特别是保护和消毒。
• Process for the antimicrobial treatment of fiber materials
  申请人：Mao Jianwen

  公开号：US20050080044A1

  公开（公告）日：2005-04-14

  A process for the antimicrobial treatment of fiber materials, comprising applying to the fiber material an inclusion complex of a fiber-reactive cyclodextrin derivative with an antimicrobial agent selected from the group consisting of (a) halogeno-o-hydroxydiphenyl compounds or non-halogenated hydroxydiphenyl ether compounds; (b) phenol derivatives; (c) benzyl alcohols; (d) chlorohexidine and derivatives thereof; (e) C 12-14 alkybetaines and C 8 -C 18 fatty acid amidoaklylbetaines; (f) amphoteric surfactants; (g) trihalocarbanilides; (h) quaternary and polyquaternary compounds; and (i) thiazole compounds.

  一种用于纤维材料抗菌处理的方法，包括将纤维材料涂覆一种纤维反应性环糊精衍生物与从以下组中选择的抗菌剂形成的包含复合物，所述组包括(a) 卤代-邻羟基二苯基化合物或非卤代羟基二苯醚化合物；(b) 酚衍生物；(c) 苄醇；(d) 氯己定及其衍生物；(e) C12-14烷基甜菜碱和C8-C18脂肪酸酰胺甜菜碱；(f) 两性表面活性剂；(g) 三卤代对氯二苯胺；(h) 季铵盐和聚季铵化合物；以及(i) 噻唑类化合物。
• [EN] ANTIMICROBIAL COMPOPSITION COMPRISING A POLYMERIC BIGUANIDE AND A COPOLYMER AND THEIR USE THEREOF<br/>[FR] COMPOSITION ANTIMICROBIENNE CONTENANT UN BIGUANIDE POLYMERIQUE ET UN COPOLYMERE ET UTILISATION ASSOCIEE
  申请人：ARCH UK BIOCIDES LTD

  公开号：WO2004100663A1

  公开（公告）日：2004-11-25

  The present invention relates to a composition comprising: (i) an antimicrobial agent; and (ii) a non-ionic co-polymer of Formula (1) wherein: [A] is of Formula (9), [B] is of Formula (10), and [X] is of Formula (11), wherein [A] and [B] may be in any order; T is an optionally substituted substituent; L is an optionally substituted linking group; R1, R2 and R3 are each independently H, optionally substituted C1-20-alkyl or optionally substituted C 3-20-cycloalkyl; R4 and R5 are each independently H or C1-4alkyl; q is 15 to 1000; p is 3 to 50; and the molar ratio of [A] to [B] (m:n), is 1:10 to 10:1; provided that R1, R2, R3, T and L do not contain an ionisable group and provided that at least one of R4 and R5 is H.

  本发明涉及一种组合物，包括：(i)一种抗菌剂；和(ii)一种非离子共聚物，其化学式为(1)，其中：[A]的化学式为(9)，[B]的化学式为(10)，[X]的化学式为(11)，其中[A]和[B]可以以任何顺序存在；T是可选的取代基；L是可选的取代连接基；R1、R2和R3分别是H、可选的取代C1-20烷基或可选的取代C3-20环烷基；R4和R5分别是H或C1-4烷基；q为15至1000；p为3至50；[A]与[B]的摩尔比(m:n)为1:10至10:1；但要求R1、R2、R3、T和L不含有离子化基团，并且至少有一个R4和R5是H。