3-[4-[[4-(bromomethyl)phenyl]methoxy]-1-oxoisoindolin-2-yl]piperidine-2,6-dione | 1323407-86-8

分子结构分类

有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物

中文名称

——

中文别名

——

英文名称

3-[4-[[4-(bromomethyl)phenyl]methoxy]-1-oxoisoindolin-2-yl]piperidine-2,6-dione

英文别名

3-[7-[[4-(bromomethyl)phenyl]methoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione

3-[4-[[4-(bromomethyl)phenyl]methoxy]-1-oxoisoindolin-2-yl]piperidine-2,6-dione化学式

CAS

1323407-86-8

化学式

C₂₁H₁₉BrN₂O₄

mdl

——

分子量

443.297

InChiKey

UKDJFJFNXHFXJD-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

702.1±60.0 °C(Predicted)
密度：

1.531±0.06 g/cm3(Predicted)
pKa：

10.69±0.40 (Predicted,Most Acidic Temp: 25 °C)

计算性质

辛醇/水分配系数(LogP)：

2.2
重原子数：

28
可旋转键数：

5
环数：

4.0
sp3杂化的碳原子比例：

0.29
拓扑面积：

75.7
氢给体数：

1
氢受体数：

4

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
——	3-[4-[[4-(hydroxymethyl)phenyl]methoxy]-1-oxoisoindolin-2-yl]piperidine-2,6-dione	1323404-89-2	C₂₁H₂₀N₂O₅	380.4
——	methyl 5-amino-4- [4-[[4-(bromomethyl)phenyl]methoxy]-1-oxoisoindolin-2-yl]-5-oxo-pentanoate	——	C₂₂H₂₃BrN₂O₅	475.339
3-(4-羟基-1-氧代异吲哚-2-基)哌啶-2,6-二酮	3-(4-hydroxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione	1061604-41-8	C₁₃H₁₂N₂O₄	260.249
——	methyl 5-amino-4-(4-hydroxy-1-oxoisoindolin-2-yl)-5-oxopentanoate	1323407-16-4	C₁₄H₁₆N₂O₅	292.291
——	methyl 5-amino-4-(4-(tert-butyl(dimethyl)silyl)oxy-1-oxoisoindolin-2-yl)-5-oxopentanoate	1323407-19-7	C₂₀H₃₀N₂O₅Si	406.554

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	3-{4-[4-(4-Benzoyl-piperazin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-84-0	C₃₂H₃₂N₄O₅	552.63
——	3-(4-((4-((4-isopropylpiperazin-1-yl)methyl)benzyl)oxy)-1-oxoisoindolin-2-yl)piperidine-2,6-dione	1323405-74-8	C₂₈H₃₄N₄O₄	490.602
——	3-(1-OXO-4-(4-(THIOMORPHOLINOMETHYL)BENZYLOXY) ISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE	1323403-01-5	C₂₅H₂₇N₃O₄S	465.573
——	3-{4-[4-(3,3-difluoro-azetidin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-89-9	C₂₄H₂₃F₂N₃O₄	455.461
——	3-{1-oxo-4-[4-(1-oxo-thiomorpholin-4-ylmethyl)-benzyloxy]-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-02-6	C₂₅H₂₇N₃O₅S	481.572
——	3-{4-[4-(2,3-DIHYDRO-5H-BENZO[F][1,4]OXAZEPIN-4-YL METHYL)-BENZYLOXY]-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL}-PIPERIDINE-2,6-DIONE	1323403-41-3	C₃₀H₂₉N₃O₅	511.577
——	3-{-4-[4-(3,3-difluoro-pyrrolidin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-93-5	C₂₅H₂₅F₂N₃O₄	469.488
——	3-{4-[4-(2-Oxa-6-aza-spiro[3.3]hept-6-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-80-0	C₂₆H₂₇N₃O₅	461.517
——	3-(4-{4-[4-(1-Hydroxy-1-methyl-ethyl)-piperidin-1-ylmethyl]-benzyloxy}-1-oxo-1,3-dihydro-isoindol-2-yl)-piperidine-2,6-dione	1323405-91-9	C₂₉H₃₅N₃O₅	505.614
——	3-{1-Oxo-4-[4-(3-phenoxy-azetidin-1-ylmethyl)-benzyloxy]-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-85-5	C₃₀H₂₉N₃O₅	511.577
——	3-{4-[4-(4-Benzyl-piperidin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-85-1	C₃₃H₃₅N₃O₄	537.659
——	3-{4-[4-(4-cyclohexanecarbonyl-piperazin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-83-9	C₃₂H₃₈N₄O₅	558.678
——	3-(1-oxo-4-((4-((4-phenylpiperazin-1-yl)methyl)benzyl)oxy)isoindolin-2-yl)piperidine-2,6-dione	1323405-76-0	C₃₁H₃₂N₄O₄	524.619
——	3-(4-((4-((4-(METHYLSULFONYL)PIPERIDIN-1-YL)METHYL) BENZYL)OXY)-1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE	1323405-82-8	C₂₇H₃₁N₃O₆S	525.626
——	3-{1-Oxo-4-[4-(3,4,5,6-tetrahydro-2H-[4,4']bipyridinyl-1-ylmethyl)-benzyloxy]-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-92-0	C₃₁H₃₂N₄O₄	524.619
——	3-{1-OXO-4-[4-(3,3,4,4-TETRAFLUORO-PYRROLIDIN-1-YL METHYL)-BENZYLOXY]-1,3-DIHYDRO-ISOINDOL-2-YL}-PIPERIDINE-2,6-DIONE	1323403-97-9	C₂₅H₂₃F₄N₃O₄	505.469
——	3-(4-{4-[4-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-benzyloxy}-1-oxo-1,3-dihydro-isoindol-2-yl)-piperidine-2,6-dione	1323406-04-7	C₃₃H₃₄FN₃O₄	555.649
——	3-{-4-[4-(3-methyl-3-phenoxy-azetidin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-92-4	C₃₁H₃₁N₃O₅	525.604
——	3-[4-[4-(4-ETHANESULFONYL-PIPERAZIN-1-YLMETHYL)-BENZYLOXY]-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL]-PIPERIDINE-2,6-DIONE	1323405-88-4	C₂₇H₃₂N₄O₆S	540.64
——	3-(4-[4-[4-(4-FLUORO-PHENYL)-PIPERIDIN-1-YLMETHYL]-BENZYLOXY]-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PIPERIDINE-2,6-DIONE	1323406-03-6	C₃₂H₃₂FN₃O₄	541.622
——	3-(4-((4-((4-(4-fluorophenyl)piperazin-1-yl)methyl)benzyl)oxy)-1-oxoisoindolin-2-yl)piperidine-2,6-dione	——	C₃₁H₃₁FN₄O₄	542.61
——	3-(1-oxo-4-{4-[4-(propane-2-sulfonyl)-piperazin-1-ylmethyl]-benzyloxy}-1,3-dihydro-isoindol-2-yl)-piperidine-2,6-dione	1323405-90-8	C₂₈H₃₄N₄O₆S	554.667
——	3-(4-((4-((2-METHYL-1H-IMIDAZOL-1-YL)METHYL)BENZYL) OXY)-1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE	1323403-11-7	C₂₅H₂₄N₄O₄	444.49
——	3-(4-[4-[4-(3-FLUORO-PHENYL)-PIPERIDIN-1-YLMETHYL]-BENZYLOXY]-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PIPERIDINE-2,6-DIONE	1323406-05-8	C₃₂H₃₂FN₃O₄	541.622
——	3-[1-OXO-4-[4-(4-PYRIDIN-2-YL-PIPERAZIN-1-YLMETHYL)-BENZYLOXY]-1,3-DIHYDRO-ISOINDOL-2-YL]-PIPERIDINE-2,6-DIONE	——	C₃₀H₃₁N₅O₄	525.607
——	3-{4-[4-(4-Hydroxy-4-phenyl-piperidin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-94-2	C₃₂H₃₃N₃O₅	539.631
——	3-{4-[4-(4-CYCLOPROPANESULFONYL-PIPERAZIN-1-YL METHYL)-BENZYLOXY]-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL}-PIPERIDINE-2,6-DIONE	1323405-79-3	C₂₈H₃₂N₄O₆S	552.651
——	3-(4-((4-((4,5-DIMETHYL-1H-IMIDAZOL-1-YL)METHYL)BENZYL) OXY)-1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE	1323403-24-2	C₂₆H₂₆N₄O₄	458.517
——	3-(4-((4-((4-(2,4-difluorophenyl)piperazin-1-yl)methyl)benzyl)oxy)-1-oxoisoindolin-2-yl)piperidine-2,6-dione	——	C₃₁H₃₀F₂N₄O₄	560.6
——	3-{4-[4-(4-benzenesulfonyl-piperazin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-93-1	C₃₁H₃₂N₄O₆S	588.684
——	3-{1-OXO-4-[4-(4-TRIFLUOROMETHYL-IMIDAZOL-1-YL METHYL)-BENZYLOXY]-1,3-DIHYDRO-ISOINDOL-2-YL}-PIPERIDINE-2,6-DIONE	1323404-02-9	C₂₅H₂₁F₃N₄O₄	498.461
——	3-{4-[4-(6,7-Dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323403-96-8	C₂₈H₂₇N₃O₄S	501.606
——	3-{4-[4-(4-cyclohexanesulfonyl-piperazin-1-ylmethyl)-benzyloxy]-1-oxo-1,3-dihydro-isoindol-2-yl}-piperidine-2,6-dione	1323405-80-6	C₃₁H₃₈N₄O₆S	594.732