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达卡巴嗪 | 4342-03-4

达卡巴嗪
Dacarbazine
4342-03-4
C6H10N6O
182.1832
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:达卡巴嗪结构式
87560054
达卡巴嗪价格
简介
Dacarbazine 是一种细胞周期非特异性抗肿瘤 (antineoplastic) 烷基化剂。Dacarbazine 抑制 T 和B淋巴细胞反应,IC50 分别为 50 和 10 μg/ml。Dacarbazine 可用于转移性恶性黑色素瘤的研究。
名称和标识符
MDL MFCD00057167
InChIKey FDKXTQMXEQVLRF-ZHACJKMWSA-N
Inchi 1S/C6H10N6O/c1-12(2)11-10-6-4(5(7)13)8-3-9-6/h3H,1-2H3,(H2,7,13)(H,8,9)/b11-10+
SMILES O=C(C1=C(/N=N/N(C([H])([H])[H])C([H])([H])[H])N=C([H])N1[H])N([H])[H]
别名信息
- 中文别名 -
  • 达卡巴嗪
  • 氮烯唑胺
  • 甲嗪咪唑胺
  • 抗黑瘤
  • 三氮烯咪唑胺
  • 三嗪咪唑胺
  • 5-(3,3-二甲基-1-三氮烯)咪唑-4-羧酰胺
  • 氮烯咪胺
  • Dacarbazine
  • 达卡巴嗪
  • 达卡巴嗪标准品
  • 三嗪唑胺
  • 他克莫司
  • 达卡巴嗪,氮烯唑胺
  • 达卡比嗪
- 英文别名 -
  • dacarbazine
  • (dimethyltriazeno)imidazolecarboxamide
  • 4-(3,3-dimethyl-1-triazeno)imidazole-5-carboxamide
  • 4-(5)-(3,3-dimethyl-1-triazeno)imidazole-5(4)-carboxamide
  • 5-(3,3-dimethyl-1-triazeno)-imidazole-4-carboxamid
  • 5-(3,3-dimethyl-1-triazenyl)-1h-imidazole-4-carboxamid
  • 5-(3,3-dimethyltriazeno)imidazole-4-carboxamide
  • 5-(dimethyltriazeno)imidazole-4-carboxamide
  • C6H10N6O
  • Imidazole Carboxamide
  • 5-(3,3-dimethyl-1-triazenyl)-1H-imidazole-4-carboxamide
  • 5-(3,3-dimethyl-1-triazenyl)imidazole-4-carboxamide
  • 5-(3,3-Dimethyl-1-triazenyl)imidazole-4-carboxamide DTIC
  • 5-(3,3-dimethyl-l-triazenyl)imidazole-4-carboxamide
  • 5-(3,3-dimethyltriazen-1-yl)-imidazole-4-carboxamide
  • deticene
  • DICARBAZINE
  • DTIC
  • dtic-aome
  • dtic-dome
  • DTIE
  • 4-(3,3-Dimethyltriazeno)imidazole-5-carboxamide
  • 4-(Dimethyltriazeno)imidazole-5-carboxamide
  • Biocarbazine
  • Biocarbazine R
  • ICDMT
  • Decarbazine
  • ICDT
  • Dacarbazinum
  • Dacarbazinum [INN-Latin]
  • Dacarbazino [INN-Spanish]
  • Dtic-Dome (TN)
  • 5-(3,3-Dimethyl-1-triazeno)imidazole-4-carboxamide
  • Di-me-triazenoimidazolecarboxamide
  • NSC45388
  • 4-(3,3-Dimethyl-1-triazeno)im
  • NCI-C0
  • CID 135398738
  • Dacarbazine
  • 5-(3,3-dimethyltriaz-1-en-1-yl)-1H-imidazole-4-carboxamide
  • (5E)-5-(dimethylaminohydrazono)imidazole-4-carboxamide
  • Tox21_201010
  • Dimethyl (triazeno) imidazolecarboxamide
  • HMS2091I20
  • Dacarbazine-DTIC
  • 4-[(E)-dimethylaminodiazenyl]-1H-imidazole-5-carboxamide
  • DACARBAZINE [JAN]
  • 4(5)-(3,3-Dimethyl-1-triazeno)imidazole-5(4)-carboxamide
  • DACARBAZINE [USP MONOGRAPH]
  • Deticene
  • DB00851
  • HY-B0078
  • CHEMBL476
  • D00288
  • (5E)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide
  • 1 H-IMIDAZOLE-4-CARBOXAMIDE, 5-(3,3-DIMETHYL-1-TRIAZENYL)-
  • 5-(3-3-dimethyl-1-triazenyl)-1H-imidazole-4-carboxamide
  • CS-1772
  • L01AX04
  • DACARBAZINE (USP MONOGRAPH)
  • AI3-52825
  • Imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazenyl)-
  • UNII-7GR28W0FJI
  • CAS-4342-03-4
  • EINECS 224-396-1
  • 4(5)-(3,3-Dimethyl-1-triazeno)imidazole-4-carboxamide
  • Imidazole-4-carboxamide,3-dimethyl-1-triazeno)-
  • 4-(or 5)-(3,3-Dimethyl-1-triazeno)imidazole-5(or 4)-carboxamide
  • 94361-71-4
  • CHEBI:94587
  • 1H-Imidazole-4-carboxamide,3-dimethyl-1-triazenyl)-
  • 4-(or 5)-(3,3-Dimethyl-1-triazeno)imidazole-5(or 4)-carboxamide
  • Dacarbasine
  • CCG-40272
  • Dakarbazin
  • A826278
  • DACARBAZINUM [WHO-IP LATIN]
  • DACARBAZINE (EP MONOGRAPH)
  • Carboxamide,3-dimethyl-1-triazeno)imidazole-4-
  • DACARBAZINE [INN]
  • NCGC00091861-04
  • Pharmakon1600-01500218
  • 750512-03-9
  • 4-(5)-(3,3-Dimethyl-1-triazeno)imidazole-5(4)-carboxamide
  • SPECTRUM1500218
  • dacarbazina
  • SR-05000001598
  • (Dimethyltriazeno)imidazolecarboxamide
  • NCGC00091861-01
  • Dimethyl Triazeno Imidazole Carboxamide
  • AKOS026750028
  • Dacarbazina Almirall
  • DACARBAZINE (USP-RS)
  • NSC799994
  • Imidazole carboxamide
  • dimethyl-triazeno-imidazole carboxamide
  • CHEBI:177836
  • Dacarbazine, European Pharmacopoeia (EP) Reference Standard
  • DACARBAZINE [VANDF]
  • C06936
  • NCI-C04717
  • Tox21_111171_1
  • NCGC00091861-07
  • (5E)-5-(dimethylaminohydrazinylidene)-4-imidazolecarboxamide
  • NSC-45388
  • Dicarbazine
  • NSC 45388
  • Dimethyl Triazeno Imidazol Carboxamide
  • DACARBAZINE (MART.)
  • 4-(3,3-Dimethyl-1-triazeno)imidazole-5-carboxamide
  • Dacarbazino
  • 5- (3,3-Dimethyl-1-triazenyl) imidazole-4-carboxamide
  • Z2289761610
  • Dacarbazine, Pharmaceutical Secondary Standard
  • Certified Reference Material
  • SCHEMBL5561
  • NCGC00091861-03
  • DTIC-Dome
  • IMIDAZOLE-4-CARBOXAMIDE, 5-(3,3-DIMETHYL-1-TRIAZENO1-
  • DTXSID0020369
  • BDBM233149
  • NCGC00258563-01
  • Dimethyl-triazeno-imidazole-carboximide
  • MFCD00057167
  • FDKXTQMXEQVLRF-ZHACJKMWSA-N
  • SBI-0051328.P003
  • BRD-K35520305-001-07-8
  • Fauldetic
  • (E)-Dacarbazine
  • WLN: T5M CNJ DVZ ENUNN1&1
  • KS-5186
  • Imidazole Carboxamide Dimethyltriazeno
  • Imidazole-4(or 5)-carboxamide, 5(or 4)-(3,3-dimethyl-1-triazeno)-
  • DACARBAZINE [IARC]
  • Imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazeno)-
  • 5(or 4)-(dimethyltriazeno)imidazole-4(or 5)-carboxamide
  • DACARBAZINE [MI]
  • 5-(3,3-Dimethyl-1-triazenyl)imidazole-4-carboxamide
  • s1221
  • 5-(3,3-Dimethyltriaz-1-enyl)-1H-imidazole-4-carboxamide
  • Asercit
  • 1H-imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazenyl)-
  • Dacarbazine [USAN:USP:INN:BAN:JAN]
  • HMS2090A20
  • AKOS015850745
  • EN300-7357020
  • NSC-799994
  • CCG-35381
  • 5-(3,3-Dimethyl-1-triazenyl)-1H-imidazole-4-carboxamide
  • 5-(dimethyltriaz-1-en-1-yl)-1H-imidazole-4-carboxamide
  • 4-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-1H-imidazole-5-carboxamide
  • Imidazole-4(or 5)-carboxamide,3-dimethyl-1-triazeno)-
  • HSDB 3219
  • Carboxamide, Dimethyl Imidazole
  • SCHEMBL1014331
  • Tox21_111171
  • SR-05000001598-1
  • NCGC00091861-02
  • Detimedac
  • Dacarbazine (DTIC-Dome)
  • NSC759610
  • Carboxamide, 5-(3,3-dimethyl-1-triazeno)imidazole-4-
  • Dacarbazine, British Pharmacopoeia (BP) Reference Standard
  • DACARBAZINE [HSDB]
  • 4-[(E)-dimethylaminoazo]-1H-imidazole-5-carboxamide
  • 5-(Dimethyltriazeno)imidazole-4-carboximide
  • BRD-K35520305-001-04-5
  • 7GR28W0FJI
  • 5-(3,3-Dimethyltriazeno)imidazole-4-carboxamide
  • 5-[(1E)-dimethyltriaz-1-en-1-yl]-1H-imidazole-4-carboxamide
  • Dacarbazin
  • CCG-36068
  • NCGC00188955-01
  • DTXCID20369
  • NSC-759610
  • CCRIS 190
  • WR-139007
  • NCI C04717
  • Imidazole Carboxamide, Dimethyl
  • DACARBAZINE [WHO-DD]
  • W-106228
  • DACARBAZINE [EP MONOGRAPH]
  • 4342-03-4
  • DACARBAZINE [USP-RS]
  • Dimethyltriazenoimidazolecarboxamide
  • 5-(Dimethyltriazeno)imidazole-4-carboxamide
  • DACARBAZINE [ORANGE BOOK]
  • Dacatic
  • DACARBAZINE [MART.]
  • DACARBAZINE [WHO-IP]
  • AKOS005220502
  • DACARBAZINE [USAN]
  • Dacarbazine (JAN/USP/INN)
  • NCGC00091861-05
  • DACARBAZINE (IARC)
  • SR-05000001598-3
  • Dacarbazine, United States Pharmacopeia (USP) Reference Standard
  • HMS501A08
  • (5Z)-5-(dimethylaminohydrazono)imidazole-4-carboxamide
  • SCHEMBL5560
物化性质
实验特性
LogP 0.76920
PSA 99.73000
Merck 2798
折射率 1.7500 (estimate)
水溶性 Slightly soluble in water, DMSO and ethanol /n
沸点 315.57°C (rough estimate)
熔点 255°C(dec.)(lit.)
蒸气压 0.0±1.1 mmHg at 25°C
闪点 229.7±31.5 °C
溶解度 less than 0.1 mg/mL at 59° F (NTP, 1992)
颜色与性状 微黄色结晶或粉末
溶解性 易溶于酸,微溶于甲醇,乙醇,不溶于水
敏感性 对热和光线敏感
密度 1.3206 (rough estimate)
计算特性
精确分子量 182.09200
氢键供体数量 2
氢键受体数量 5
可旋转化学键数量 3
同位素质量 182.09160896 g/mol
重原子数量 13
复杂度 215
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 0
确定化学键立构中心数量 1
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) -0.6
互变异构体数量 9
表面电荷 0
拓扑分子极性表面积 99.7
分子量 182.18
国际标准相关数据
EINECS 45388
海关数据
海关编码 2933290090
海关数据

中国海关编码:

2934999090

概述:

2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途

Summary:

2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

生产方法和用途
用途 抗肿瘤药,主要用于黑色素瘤,亦用于软组织肉瘤和恶性淋巴瘤等
生产方法 以氰乙酸乙酯为原料,经加成、胺化、重氮化、偶合、还原、甲酰化、环合、中和、重氮化、缩合,经过中间体β-亚胺基-β-乙氧基丙酸乙酯盐酸盐,α-脒基乙酰胺盐酸盐,α-脒基-α-苯偶氮基乙酰胺盐酸盐,5-氨基咪唑-4-羧酰胺盐酸盐而得。
专业数据库参考
PubChemId 87560054
参考资料
Reaxys RN 521487
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