960化工网
疫情期间推广专线18851634737(微信同号)
Milategrast

共找到1家“Milategrast“产品

960化工网为你提供 1 Milategrast生产厂家
名称和标识符

Inchi : 1S/C24H38N2/c1-23(2)15-20(16-24(3,4)18-23)21-7-5-6-8-22(21)26-13-11-25(12-14-26)17-19-9-10-19/h5-8,19-20H,9-18H2,1-4H3

InChIKey : PGWIKFFLIJECAM-UHFFFAOYSA-N

SMILES : N1(C([H])([H])C([H])([H])N(C([H])([H])C1([H])[H])C1=C([H])C([H])=C([H])C([H])=C1C1([H])C([H])([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C(C([H])([H])[H])(C([H])([H])[H])C1([H])[H])C([H])([H])C1([H])C([H])([H])C1([H])[H]

英文别名
  • Milategrast
  • YR5R4CIH88
  • 1-(cyclopropylmethyl)-4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine
  • Milategrast [INN]
  • GTPL10463
  • example 9 [US20050261291A1]
  • 1-cyclopropylmethyl-4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine
  • Piperazine, 1-(cyclopropylmethyl)-4-(2-(3,3,5,5-tetramethylcyclohexyl)phenyl)-
物化性质
计算特性

氢键供体数量 : 0

氢键受体数量 : 2

重原子数量 : 26

可旋转化学键数量 : 4

复杂度 : 455

疏水参数计算参考值(XlogP) : 6.4

拓扑分子极性表面积 : 6.5