tert-butyl 3-cyclohexyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-6-carboxylate | 1204417-91-3
中文名称
——
中文别名
——
英文名称
tert-butyl 3-cyclohexyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-6-carboxylate
英文别名
——
CAS
1204417-91-3
化学式
C25H36BNO4
mdl
——
分子量
425.376
InChiKey
FTMQHSORCUZPBT-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
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物化性质
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计算性质
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ADMET
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安全信息
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SDS
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制备方法与用途
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上下游信息
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文献信息
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表征谱图
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同类化合物
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相关功能分类
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相关结构分类
物化性质
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沸点：553.6±50.0 °C(Predicted)
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密度：1.11±0.1 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：5.47
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重原子数：31
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可旋转键数：5
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环数：4.0
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sp3杂化的碳原子比例：0.64
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拓扑面积：60.6
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氢给体数：1
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氢受体数：4
上下游信息
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上游原料
中文名称 英文名称 CAS号 化学式 分子量 2-溴-3-环己基-1H-吲哚-6-羧酸叔丁酯 tert-butyl 2-bromo-3-cyclohexyl-1H-indole-6-carboxylate 879498-90-5 C19H24BrNO2 378.309 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 3-环己基-2-(2-甲酰基-4-甲氧基苯基)-1H-吲哚-6-羧酸1,1-二甲基乙基酯 1H-indole-6-carboxylic acid, 3-cyclohexyl-2-(2-formyl-4-methoxyphenyl)-, 1,1-dimethylethyl ester 958002-18-1 C27H31NO4 433.547 —— tert-butyl 3-cyclohexyl-2-(4-fluoro-2-formylphenyl)-1H-indole-6-carboxylate 1204417-92-4 C26H28FNO3 421.512 —— 13-cyclohexyl-3-methoxy-6-{2-[methyl-(2-methylamino-ethyl)-amino]-ethylcarbamoyl}-7H-benzo[3,4]azepino[1,2-a]indole-10-carboxylic acid tert-butyl ester 1204417-36-6 C36H48N4O4 600.802 —— 7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid, 13-cyclohexyl-3-methoxy-, 10-(1,1-dimethylethyl) ester 1038924-00-3 C30H33NO5 487.596 —— 2-chloro-13-cyclohexyl-10-[(2-methylpropan-2-yl)oxycarbonyl]-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid 1204417-98-0 C29H30ClNO4 492.014 —— tert-butyl 13-cyclohexyl-3-methoxy-6-[5-(methylamino)pentylcarbamoyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate 1204417-84-4 C36H47N3O4 585.787 —— 13-cyclohexyl-3-methoxy-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid 10-(1,1-dimethylethyl) ester 6-methyl ester 928844-30-8 C31H35NO5 501.623 —— 10-O-tert-butyl 6-O-methyl 2-chloro-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate 1204417-97-9 C30H32ClNO4 506.041 —— 10-tert-butyl 6-methyl 13-cyclohexyl-3-chloro-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate 1204417-95-7 C30H32ClNO4 506.041 —— 13-cyclohexyl-3-methoxy-6-[[methyl[2-[2-(methylamino)ethoxy]ethyl]amino]carbonyl]-7H-Iindolo[2,1-a][2]benzazepine-10-carboxylic acid, 1,1-dimethylethyl ester 1204417-25-3 C36H47N3O5 601.786 —— tert-butyl 13-cyclohexyl-3-methoxy-6-[5-[methyl(sulfamoyl)amino]pentylcarbamoyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate 1204417-85-5 C36H48N4O6S 664.866 —— 10-tert-butyl 6-methyl 13-cyclohexyl-3-fluoro-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate 1204417-90-2 C30H32FNO4 489.587 —— 6-[[[2-[2-[(aminosulfonyl)methylamino]ethoxy] ethyl]methylamino]carbonyl]-13-cyclohexyl-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid, 1,1-dimethylethyl ester 1204417-26-4 C36H48N4O7S 680.866 —— Tert-butyl 10-carbonochloridoyl-19-cyclohexyl-5-methoxy-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxylate 1204417-44-6 C31H34ClNO4 520.068 —— 13-cyclohexyl-3-methoxy-6-(methoxycarbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid 945686-02-2 C27H27NO5 445.515 —— 13-cyclohexyl-3-methoxy-10-[[methyl-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]ethyl]sulfamoyl]carbamoyl]-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid 1204417-74-2 C38H49N5O8S 735.902 —— (4bR,5aS)-9-(tert-butoxycarbonyl)-12-cyclohexyl-3-methoxy-4b,5,5a,6-tetrahydrobenzo[3,4]cyclopropa[5,6]azepino-[1,2-a]indole-5a-carboxylic acid 1059700-79-6 C31H35NO5 501.623 —— (4bR,5aS)-9-(tert-butoxycarbonyl)-12-cyclohexyl-3-methoxy-4b,5,5a,6-tetrahydrobenzo[3,4]cyclopropa[5,6]azepino[1,2-a]indole-5a-carboxylic acid 1204417-51-5 C31H35NO5 501.623 —— 6-[[[2-[2-[(aminosulfonyl)methylamino]ethoxy]ethyl]methylamino]carbonyl]-13-cyclohexyl-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid 1204417-27-5 C32H40N4O7S 624.758 —— cycloprop[d]indolo[2,1-a][2]benzazepine-1a, 5(2H)-dicarboxylic acid, 8-cyclohexyl-1,12b-dihydro-11-methoxy-, 5-(1,1-dimethylethyl) 1a-methyl ester, (+/-) —— C32H37NO5 515.649 —— 28-Cyclohexyl-22-methoxy-10,13-dimethyl-9,9-dioxo-9lambda6-thia-1,8,10,13,16-pentazapentacyclo[16.8.1.12,6.13,26.020,25]nonacosa-2,4,6(29),18,20(25),21,23,26(28)-octaene-7,17-dione 1204417-02-6 C32H39N5O5S 605.758 —— methyl 13-cyclohexyl-3-methoxy-10-[[methyl-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]ethyl]sulfamoyl]carbamoyl]-7H-indolo[2,1-a][2]benzazepine-6-carboxylate 1204417-73-1 C39H51N5O8S 749.929 —— 13-cyclohexyl-3-methoxy-6-[5-[methyl(sulfamoyl)amino]pentylcarbamoyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid 1204417-86-6 C32H40N4O6S 608.759 —— 28-Cyclohexyl-22-methoxy-13-methyl-9,9-dioxo-9lambda6-thia-1,8,10,13,16-pentazapentacyclo[16.8.1.12,6.13,26.020,25]nonacosa-2,4,6(29),18,20(25),21,23,26(28)-octaene-7,17-dione 1204417-18-4 C31H37N5O5S 591.731 —— 30-Cyclohexyl-7-methoxy-21-methyl-20,20-dioxo-20lambda6-thia-1,12,19,21,24-pentazahexacyclo[22.2.2.13,12.111,14.113,17.05,10]hentriaconta-3,5(10),6,8,11(30),13,15,17(29)-octaene-2,18-dione 1204417-10-6 C33H39N5O5S 617.769 —— methyl 13-cyclohexyl-10-(imidazole-1-carbonyl)-3-methoxy-7H-indolo[2,1-a][2]benzazepine-6-carboxylate 1204417-68-4 C30H29N3O4 495.578 —— 13-cyclohexyl-3-methoxy-10-[[methyl(2-piperazin-1-ylethyl)sulfamoyl]carbamoyl]-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid 1204417-75-3 C33H41N5O6S 635.784 —— 30-Cyclohexyl-15-methoxy-2,2-dioxo-2lambda6-thia-1,3,10,21,24-pentazahexacyclo[22.2.2.15,9.18,11.110,19.012,17]hentriaconta-5(31),6,8,11(30),12(17),13,15,18-octaene-4,20-dione 1204417-01-5 C32H37N5O5S 603.742 —— (1aS,12bR)-1a-[(2-{2-[(aminosulfonyl)(methyl)amino]ethoxy}ethyl)(methyl)carbamoyl]-8-cyclohexyl-11-methoxy-1,1a,2,12b-tetrahydrocyclopropa[d]indolo[2,1-a][2]benzazepine-5-carboxylic acid 1204417-54-8 C33H42N4O7S 638.785 —— (1aR,12bS)-1a-[(2-{2-[(aminosulfonyl)(methyl)amino]ethoxy}ethyl)(methyl)carbamoyl]-8-cyclohexyl-11-methoxy-1,1a,2,12b-tetrahydrocyclopropa[d]indolo[2,1-a][2]benzazepine-5-carboxylic acid 1204417-50-4 C33H42N4O7S 638.785 —— 29-Cyclohexyl-23-methoxy-10,17-dimethyl-9,9-dioxo-9lam