4-(2-pyrimidinyl)-1-Piperazinecarboxylic acid ethyl ester | 99931-83-6
4-(2-pyrimidinyl)-1-Piperazinecarboxylic acid ethyl ester
99931-83-6
C11H16N4O2
236.27034
名称和标识符
MDL |
MFCD02571455 |
InChIKey |
PXNBCBKGSZGMFC-UHFFFAOYSA-N |
Inchi |
InChI=1S/C11H16N4O2/c1-2-17-11(16)15-8-6-14(7-9-15)10-12-4-3-5-13-10/h3-5H,2,6-9H2,1H3 |
SMILES |
CCOC(=O)N1CCN(CC1)C2=NC=CC=N2 |
别名信息
- 英文别名 -
- 4-(2-pyrimidinyl)-1-Piperazinecarboxylic acid ethyl ester
- Ethyl 4-(2-pyrimidinyl)-1-piperazinecarboxylate
- Oprea1_434752
- Oprea1_434752
- ethyl 4-(2-pyrimidinyl)tetrahydro-1(2H)-pyrazinecarboxylate
- ethyl 4-(2-pyrimidinyl)tetrahydro-1(2H)-pyrazinecarboxylate
- ethyl 4-pyrimidin-2-ylpiperazine-1-carboxylate
- ethyl 4-pyrimidin-2-ylpiperazine-1-carboxylate
- SCHEMBL10849115
- SCHEMBL10849115
- SCHEMBL10849115
- AKOS003799217
- AKOS003799217
- AKOS003799217
- Ethyl4-(pyrimidin-2-yl)piperazine-1-carboxylate
- Ethyl4-(pyrimidin-2-yl)piperazine-1-carboxylate
- Ethyl4-(pyrimidin-2-yl)piperazine-1-carboxylate
- MFCD02571455
- MFCD02571455
- MFCD02571455
- 99931-83-6
- 99931-83-6
- 99931-83-6
- ethyl 4-(pyrimidin-2-yl)piperazine-1-carboxylate
- ethyl 4-(pyrimidin-2-yl)piperazine-1-carboxylate
- ethyl 4-(pyrimidin-2-yl)piperazine-1-carboxylate
- ethyl 4-(pyrimidin-2-yl)piperazine-1-carboxylate
- ethyl 4-(2-pyrimidinyl)tetrahydropyrazine-1(2h)-carboxylate
- ethyl 4-(2-pyrimidinyl)tetrahydropyrazine-1(2h)-carboxylate
- ethyl 4-(2-pyrimidinyl)tetrahydropyrazine-1(2h)-carboxylate
- ethyl 4-(2-pyrimidinyl)tetrahydropyrazine-1(2h)-carboxylate
- 8R-0659
- 8R-0659
- 8R-0659
- 8R-0659
物化性质
计算特性
精确分子量 |
236.12732577g/mol |
氢键供体数量 |
0 |
氢键受体数量 |
5 |
可旋转化学键数量 |
3 |
同位素质量 |
236.12732577g/mol |
重原子数量 |
17 |
复杂度 |
248 |
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 |
0 |
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) |
0.7 |
拓扑分子极性表面积 |
58.6Ų |
4-(2-pyrimidinyl)-1-Piperazinecarboxylic acid ethyl ester推荐生产厂家