166814-31-9 ((methyl 4,5,6,7-tetrahydro-3H-imidazo4,5-cpyridine-4-carboxylate dihydrochloride)

CAS号:
166814-31-9
英文名称:
methyl 4,5,6,7-tetrahydro-3H-imidazo4,5-cpyridine-4-carboxylate dihydrochloride
分子式:
C8H11N3O2
分子量:
181.191841363907

methyl 4,5,6,7-tetrahydro-3H-imidazo4,5-cpyridine-4-carboxylate dihydrochloride(166814-31-9)名称与标识符

名称

英文别名:
Methyl 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-4-carboxylate;T5788;3H-imidazo[4,5-c]pyridine-4-carboxylic acid, 4,5,6,7-tetrahydro-, methyl ester, dihydrochloride;

标识符

InChIKey:
FZPHSUBVENHRPC-UHFFFAOYSA-N
Inchi:
1S/C8H11N3O2/c1-13-8(12)7-6-5(2-3-9-7)10-4-11-6/h4,7,9H,2-3H2,1H3,(H,10,11)
SMILES:
O(C)C(C1C2=C(CCN1)NC=N2)=O

methyl 4,5,6,7-tetrahydro-3H-imidazo4,5-cpyridine-4-carboxylate dihydrochloride(166814-31-9)物化性质

计算特性

  • 氢键供体数量 : 2
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 2
  • 重原子数量 : 13
  • 复杂度 : 210
  • 拓扑分子极性表面积 : 67

methyl 4,5,6,7-tetrahydro-3H-imidazo4,5-cpyridine-4-carboxylate dihydrochloride(166814-31-9)推荐厂家 更多厂家(1)

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