uspto-grants-2014_07 · 10.6084/m9.figshare.5104873.v1 · US08765940B2
查看![US8765940, tert-butyl 4-(5,7-difluoro-3-methyl-4-(6'-(4-morpholinyl)-2,3,5,6-tetrahydrospiro[pyran-4,3'-pyrrolo[3,2-b]pyridin]-1'(2'H)-yl)-2-quinolinyl)-1-piperazinecarboxylate 分子结构式](/api/mol/67285378/svg/360x280.svg)
HCID67285378
US8765940, tert-butyl 4-(5,7-difluoro-3-methyl-4-(6'-(4-morpholinyl)-2,3,5,6-tetrahydrospiro[pyran-4,3'-pyrrolo[3,2-b]pyridin]-1'(2'H)-yl)-2-quinolinyl)-1-piperazinecarboxylate
tert-butyl 4-[5,7-difluoro-3-methyl-4-(6-morpholin-4-ylspiro[2H-pyrrolo[3,2-b]pyridine-3,4'-oxane]-1-yl)quinolin-2-yl]piperazine-1-carboxylate
C34H42F2N6O4636.7 g/mol
IDENTITY
结构与身份
- 标准SMILES
- Cc1c(N2CCN(C(=O)OC(C)(C)C)CC2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21
- InChIKey
- RZNSXSQJCXKGGP-UHFFFAOYSA-N
- 分子式
- C34H42F2N6O4
- 平均分子量
- 636.7 g/mol
- 单同位素质量
- 636.32356017
COMPUTED
结构计算性质
- XLogP
- 4.4
- 极性表面积
- 83.5 Ų
- 氢键供体
- 0
- 氢键受体
- 11
- 可旋转键
- 5
- 重原子
- 46
- 形式电荷
- 0
- 复杂度
- 1,060
ALIASES
名称与别名
SCHEMBL2125292CHEMBL3701668RZNSXSQJCXKGGP-UHFFFAOYSA-NBDBM124779tert-butyl 4-(5,7-difluoro-3-methyl-4-(6'-(4-morpholinyl)-2,3,5,6-tetrahydrospiro[pyran-4,3'-pyrrolo[3,2-b]pyridin]-1'(2'H)-yl)-2-quinolinyl)-1-piperazinecarboxylateUS8765940, tert-butyl 4-(5,7-difluoro-3-methyl-4-(6'-(4-morpholinyl)-2,3,5,6-tetrahydrospiro[pyran-4,3'-pyrrolo[3,2-b]pyridin]-1'(2'H)-yl)-2-quinolinyl)-1-piperazinecarboxylate
REACTIONS
参与反应
uspto-grants-2014_07 · 10.6084/m9.figshare.5104873.v1 · US08765940B2
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