产品供求
格列环脲
- 基本信息
- 物化性质
- 毒理性
- 结构与计算化学
- 上游产品
格列环脲 基本信息
- 中文名称：
- 格列环脲
- 中文别名：
- 格列环脲;
托尼达明
- 英文名称：
- Benzenesulfonamide,N-[(cyclohexylamino)carbonyl]-4-methyl-
- 英文别名：
- 1-cyclohexyl-3-(4-methylphenyl)sulfonylurea;
Glicosil;
TOLCYCLAMIDE;
Gliciclamide;
1-cyclohexyl-3-tosylurea;
Cyclamide;
Glycyclamid;
N-cyclohexyl-N'-(toluene-4-sulfonyl)-urea;
Agliral;
Cyclamid;
N-Cyclohexyl-N'-(toluol-4-sulfonyl)-harnstoff;
Cychloral;
N1-p-Toluolsulfonyl-N2-cyclohexylharnstoff;
Glycyclamide;
Tolhexamide;
N-(cyclohexylcarbamoyl)-4-methylbenzenesulfonamide
- CAS No.：
- 664-95-9
- 分 子 式：
- C14H20N2O3S
- 分 子 量：
- 296.42
- 精确分子量：
- 296.11900
- PSA：
- 83.65000
- EINECS：
- 211-557-6
- InChI：
- The Key: RIGBPMDIGYBTBJ-UHFFFAOYSA-N
- 安全术语：
- Moderately toxic by intraperitoneal route. An experimental teratogen. When heated to decomposition it emits toxic fumes of SOx and NOx.
- 分子结构式：
-
- SDS：
- 查看
格列环脲 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- YS7800000
- CHEMICAL NAME :
- Urea, 1-cyclohexyl-3-(p-tolylsulfonyl)-
- CAS REGISTRY NUMBER :
- 664-95-9
- BEILSTEIN REFERENCE NO. :
- 1995860
- LAST UPDATED :
- 199706
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C14-H20-N2-O3-S
- MOLECULAR WEIGHT :
- 296.42
- WISWESSER LINE NOTATION :
- L6TJ AMVMSWR D1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 870 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
Italy) V.8-43 1953-88 For publisher information, see FRMCE8
Volume(issue)/page/year: 12,268,1957
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1150 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- RPOBAR Research Progress in Organic-Biological and Medicinal Chemistry. (New
York, NY) V.1-3, 1964-72. Discontinued. Volume(issue)/page/year:
2,280,1970
** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 800 mg/kg
- SEX/DURATION :
- female 9 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetal death
- REFERENCE :
- FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see
PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-
1939- Volume(issue)/page/year: 28,616,1965
格列环脲 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值（XlogP）:无
2.氢键供体数量:2
3.氢键受体数量:3
4.可旋转化学键数量:3
5.互变异构体数量:3
6.拓扑分子极性表面积:83.6
7.重原子数量:20
8.表面电荷:0
9.复杂度:416
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
