CAS 908-54-3 MFCD00058386-4,4'-(Triaz-1-Ene-1,3-Diyl)Dibenzimidamide Bis(2-Acetamidoacetate) 4,4'-(三氮杂-1-烯-1,3-二基)二苯并亚胺二乙酰基甘氨酸盐 TAO{mole}

4,4'-(Triaz-1-Ene-1,3-Diyl)Dibenzimidamide Bis(2-Acetamidoacetate) 4,4'-(三氮杂-1-烯-1,3-二基)二苯并亚胺二乙酰基甘氨酸盐

CAS 908-54-3 MFCD00058386

化学结构图

SMILES: CC(=O)NCC(=O)O.CC(=O)NCC(=O)O.N=C(N)c1ccc(/N=N/Nc2ccc(C(=N)N)cc2)cc1

化学属性

Mol. Formula	C22H29N9O6
Mol. Weight	516
Appearance	黄色结晶性粉末。熔点217℃（分解）。溶于14份20℃的水，微溶于乙醇，难溶于氯仿、乙醚、丙酮。无臭，味苦。
Solubility	Soluble in water (50 mg/ml), methanol, DMSO, and alcohol (slightly)

别名和识别编码

Chemical Name	4,4'-(Triaz-1-Ene-1,3-Diyl)Dibenzimidamide Bis(2-Acetamidoacetate)
CAS Number	908-54-3
MDL Number	MFCD00058386
Synonym	Diminazene aceturate Ganaseg azidin 二脒那秦 4,4’-(diamino)dibenzamidediaceturate 贝尼尔 Di-(4-amidinophenyl)-triazen-(N-1,3)-diaceturat 4,4’-二脒基重氮氨基苯二乙尿酸 DIMINAZENE DIACETURATE 二乙酰胺三氮脒 ganasag Diaminazene aceturate Diminazene diaceturate ganaseg DIMINAZENE DIACTETURATE Di-(4-amidinophenyl)-triazine-(N-1,3)-diaceturate Glycine, N-acetyl-, compd. with 4,4'-(1-triazene-1,3-diyl)bis[benzenecarboximidamide] (2:1) 伯林尼尔 azidine Glycine, N-acetyl-, compd. with Diminazine aceturate 血虫净 glycine,n-acetyl-,compd.with4,4’-(diazoamino)dibenzamidine(2:1) di-(4-amidinophenyl)-triazine-(n-1,3)-diaceturate Azidin 1,3-双(对脒基苯)-三氮烯二乙酰甘氨酸盐 Beronal DIMINAZENE ACETURATE Berenil beronal Ganasag 4,4’-(Diazoamino)dibenzamidinediaceturate amide](2:1) 4,4'-(Diamino)dibenzamide diaceturate di-(4-amidinophenyl)-triazen-(n-1,3)-diaceturat BERENIL glycine,n-acetyl-,compd.with4,4’-(1-triazene-1,3-diyl)bis(benzenecarboxim DIMINAZINE ACETURATE diaminazeneaceturate 二乙酰胺三氮脒;贝尼尔;二脒那秦; 4,4'-二脒基重氮氨基苯二乙尿酸; 1,3-双(对脒基苯)三氮烯二乙酰甘氨酸盐 Azidine idamide)(2:1) glycine,n-acetyl-,compd.with4,4’-(1-triazene-1,3-diyl)bis[benzenecarboximid N-Acetylglycine 4,4'-(1-triazene-1,3-diyl)bis[benzenecarboxamidine] (2:1)
EC Number	212-999-2
Chemical Name Translation	4,4'-(三氮杂-1-烯-1,3-二基)二苯并亚胺二乙酰基甘氨酸盐
Wiswesser Line Notation	MUYZR DNUNMR DYZUM &QV1MV1 2
PubChem Substance ID	5284544
InChI	InChI=1S/C14H15N7.2C4H7NO3/c15-13(16)9-1-5-11(6-2-9)19-21-20-12-7-3-10(4-8-12)14(17)18;21-3(6)5-2-4(7)8/h1-8H,(H3,15,16)(H3,17,18)(H,19,20);22H2,1H3,(H,5,6)(H,7,8)
LabNetwork Molecule ID	LN00196663

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分类

{SNA} A - K, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Antibacterial, Antibiotics, Antibiotics A to Z, Antibiotics A-F, Antiparasitic / Antiprotozoal / Anthelminthic,
{SA} A - K, Alphabetic, Analytical Standards, Analytical/Chromatography, Antibacterial, Antibiotics, Antibiotics A to Z, Antibiotics A-F, Antiparasitic / Antiprotozoal / Anthelminthic, Chromatography, D, DID - DIN, Drugs & Metabolites, Forensic and Veterinary Standards, Neat Compounds, Spectrum of Activity
{SNA} A - K,
{SNA

产品应用

An anti-protozoal and anti-trypanosomal compound.

安全信息

RTECSMB7605000

WGK Germany3

Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Storage condition 储存温度-20°C 0-6°C

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BSCFAS Bulletin de la Societe Chimique de France.  (CDR-Centrale des Revues,
   11, rue Gossin, F-92543 Montrouge Cedex, France)  V.1-    1864-
   Volume(issue)/page/year: -,376,1968

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 258 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 6,674,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 663 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   RVTSA9 Research in Veterinary Science.  (British Veterinary Assoc., 7
   Mansfield St., London W1M OAT, UK)  V.1-    1960-  Volume(issue)/page/year:
   10,534,1969

TYPE OF TEST            : Micronucleus test
TEST SYSTEM             : Rodent - mouse Lymphocyte
DOSE/DURATION           : 10 umol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 300,165,1993

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 450 umol/L
REFERENCE :
   EJCODS European Journal of Cancer and Clinical Oncology.  (Pergamon Press,
   c/o Elsevier Science, 660 White Plains Rd., Tarrytown, NY 10591)  V.17(7)-
   25, 1981-89.  For publisher information, see EJCAEL Volume(issue)/page/year:
   19,1575,1983

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 8 gm/kg
SEX/DURATION            : female 8-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
REFERENCE :
   TOLED5 Toxicology Letters.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1977-  Volume(issue)/page/year: 54,55,1990

其他信息

方法一:以对硝基苯甲酸为原料，在高温下与对甲苯磺酰胺发生氰化反应，生成对硝基苯腈（C7H4N2O2[619-72-7]。然后由对硝基苯腈加成、胺化、还原、重氮化、偶合、成盐而得二脒那秦。1.加成、胺化将对硝基苯腈、甲醇、甲醇钠加入反应锅，搅拌溶解，在25-30℃反应3h。加入氯化铵，在10-15℃搅拌反应5h。回收甲醇至干，加入稀盐酸煮沸，过滤，得对硝基苯脒盐酸盐溶液。2.还原将上述溶液加热至50℃，加入冰醋酸，于60℃慢慢加入铁粉。加毕，升温至105℃反应5h。过滤，滤液用氢氧化钠溶液碱化至pH为12。过滤，用盐酸将滤液重新酸化至pH为1-2。浓缩，冷却结晶，过滤，得对氨基苯脒盐酸盐。3.重氮化、偶合先将一半量的对氨基苯脒盐酸盐加入水中，加盐酸溶解，于-5～0℃滴加10%的亚硝酸钠溶液，用碘化钾淀粉试纸检查终点，将另一半量的对氨基苯脒盐酸盐加少量水混匀后加入，再加饱和乙酸钠，析出黄色沉淀。过滤，滤饼溶于水中，用10%氢氧化钠溶液调节pH至9-10，析出结晶。过滤，滤饼用冷水和甲醇洗涤即得1,3-双（对脒基苯）-三氮烯。4.成盐将上述三氮烯、乙酰甘氨酸、甲醇搅拌0.5h后，用氨水调节至pH为7，升温回渡溶解。加活性炭，过滤，滤液冷却结晶。过滤、干燥，得二脒那秦。
上游原料:铁粉 --> 甲醇钠 --> 对硝基苯甲酸 --> 对甲苯磺酰胺 --> 碘化钾淀粉试纸 --> 对硝基苯甲腈 --> N-乙酰甘氨酸 --> 三氮烯
MOL 文件:908-54-3.mol
二乙酰胺三氮脒
Diminazene is a di-amidine also known as 4,4-(1-Triazene–1,3–diyl)bis(benzenecarboximidamide), used as an effective trypanocidal agent.
用途一:兽药。用于治疗大家畜焦虫和锥虫病。常用量，马：3-4mg/kg（体重），牛：4-7mg/kg（体重），羊：3-5mg/kg（体重）。用5%的水溶液，从肌肉或皮下注射。
Sigma Aldrich:908-54-3(sigmaaldrich)