5-甲基-2-(1-甲基乙氧基)-4-(4-哌啶)-苯胺二盐酸盐 | 1380575-45-0
5-甲基-2-(1-甲基乙氧基)-4-(4-哌啶)-苯胺二盐酸盐
2-isopropoxy-5-methyl-4-(4-piperidyl)aniline;dihydrochloride
1380575-45-0
C15H26Cl2N2O
321.2857
名称和标识符
MDL |
MFCD28387189 |
InChIKey |
GRRXEYVKIONDRW-UHFFFAOYSA-N |
Inchi |
1S/C15H24N2O.2ClH/c1-10(2)18-15-9-13(11(3)8-14(15)16)12-4-6-17-7-5-12;;/h8-10,12,17H,4-7,16H2,1-3H3;2*1H |
SMILES |
Cl[H].Cl[H].O(C([H])(C([H])([H])[H])C([H])([H])[H])C1=C(C([H])=C(C([H])([H])[H])C(=C1[H])C1([H])C([H])([H])C([H])([H])N([H])C([H])([H])C1([H])[H])N([H])[H] |
别名信息
- 中文别名 -
- 5-甲基-2-(1-甲基乙氧基)-4-(4-哌啶)-苯胺二盐酸盐
- 2-异丙氧基-5-甲基-4-(哌啶-4-基)苯胺双盐酸盐
- 5-甲基-2-异丙氧基-4-(4-哌啶基)苯胺二盐酸盐
- LDK378中间体
- 2-异丙氧基-5-甲基-4-(哌啶-4-基)苯胺二盐酸盐
- 英文别名 -
- 5-Methyl-2-(1-methylethoxy)-4-(4-piperidinyl)benzenamine hydrochloride
- CR-14
- 2-ISOPROPOXY-5-METHYL-4-(PIPERIDIN-4-YL)ANILINE DIHYDROCHLORIDE
- 5-Methyl-2-(1-Methylethoxy)-4- (4-piperidinyl)- BenzenaMine dihydrochloride
- 5-Methyl-2-(1-Methylethoxy)-4- (4-piperidinyl)- BenzenaMine hydrochloride
- LDK378 intermediate
- BCP10607
- 5-methyl-4-(piperidin-4-yl)-2-(propan-2-yloxy)aniline dihydrochloride
- SB17680
- AK543083
- 2-Isopropoxy-5-methyl-4-(4-piperidinyl)aniline dihydrochloride
- 5-methyl-4-piperidin-4-yl-2-propan-2-yloxyaniline
- dihydrochloride
- (1-Methylethoxy)-4-(4-piperidinyl)- BenzenaMine hydrochloride (1:2)
- 5-Methyl-2-(1-methylethoxy)-4-(4-piperid
- 2-isopropoxy-5-methyl-4-(4-piperidyl)aniline
- dihydrochloride
物化性质
计算特性
氢键供体数量 |
4 |
氢键受体数量 |
3 |
可旋转化学键数量 |
3 |
重原子数量 |
20 |
复杂度 |
251 |
拓扑分子极性表面积 |
47.3 |
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