(S)-2-(tert-butoxycarbonyl)-7-hydroxy-6,8-diiodo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid | 142335-41-9
中文名称
——
中文别名
——
英文名称
(S)-2-(tert-butoxycarbonyl)-7-hydroxy-6,8-diiodo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
英文别名
(3S)-7-hydroxy-6,8-diiodo-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CAS
142335-41-9
化学式
C15H17I2NO5
mdl
——
分子量
545.113
InChiKey
MEPQNSLNRRRBLD-JTQLQIEISA-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：511.0±50.0 °C(Predicted)
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密度：2.023±0.06 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：3.2
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重原子数：23
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可旋转键数：3
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环数：2.0
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sp3杂化的碳原子比例：0.47
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拓扑面积：87.1
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氢给体数：2
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氢受体数：5
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 —— (S)-7-hydroxy-6,8-diiodo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 142335-40-8 C10H9I2NO3 444.995 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 丁氧羰基-L-7-羟基-1,2,3,4-四氢化异喹啉-3-羧酸 (S)-2-(tert-butoxycarbonyl)-7-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 142335-42-0 C15H19NO5 293.32 —— (S)-7-Hydroxy-6,8-diiodo-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester 869002-63-1 C19H24I2N2O4 598.22 —— Boc-L-(1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid)(7-OH)-OMe 262616-16-0 C16H21NO5 307.346 —— (S)-2-(tert-butoxycarbonyl)-7-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 226920-21-4 C16H21NO5 307.346 —— (S)-2-tert-butyl 3-methyl 7-methoxy-3,4-dihydroisoquinoline-2,3(1H)-dicarboxylate 226920-30-5 C17H23NO5 321.373 —— (S)-tert-butyl 7-hydroxy-3-(phenethylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-38-9 C23H28N2O4 396.486 —— (S)-tert-butyl 7-hydroxy-3-(phenylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-36-7 C21H24N2O4 368.433 —— (S)-7-Hydroxy-6,8-diiodo-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-chloro-ethyl)-amide 869002-64-2 C17H20ClI2N3O3 603.626 —— (S)-tert-butyl 7-hydroxy-3-((4-methoxyphenyl)carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-39-0 C22H26N2O5 398.459 —— (S)-tert-butyl 7-(2-methoxy-2-oxoethoxy)-3-(phenethylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-61-8 C26H32N2O6 468.55 —— (S)-tert-butyl 7-(2-methoxy-2-oxoethoxy)-3-(phenylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-56-1 C24H28N2O6 440.496 —— (S)-tert-butyl 7-hydroxy-3-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate —— C25H30N2O4 422.524 —— (S)-tert-butyl 7-(2-methoxy-2-oxoethoxy)-3-((4-methoxyphenyl)carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate 1223620-63-0 C25H30N2O7 470.522 —— tert-butyl (S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-1-oxo-3-phenylpropan-2-ylcarbamate 1287261-01-1 C33H38N4O8 618.687 —— tert-butyl (S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-(4-hydroxyphenyl)-1-oxopropan-2-ylcarbamate 1287261-02-2 C33H38N4O9 634.686 —— tert-butyl ((S)-1-(((S)-1-((S)-7-hydroxy-3-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-1-oxopropan-2-yl)(methyl)carbamate —— C35H48N4O6 620.789 —— tert-butyl (S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-1-oxopropan-2-ylcarbamate 1287261-06-6 C27H34N4O8 542.589 —— (S)-tert-butyl 2-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)pyrrolidine-1-carboxylate 1287261-03-3 C29H36N4O8 568.627 —— methyl 2-((S)-2-((S)-2-(tert-butoxycarbonylamino)-3-phenylpropanoyl)3-(4-methoxyphenylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-7-yloxy)acetate 1287261-37-3 C34H39N3O8 617.699 —— methyl 2-((S)-2-((S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl)-3-(4-methoxyphenylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-7-yloxy)acetate 1287261-38-4 C34H39N3O9 633.698 —— (S)-tert-butyl 2-(7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethylcarbamate 1287261-00-0 C26H32N4O8 528.562 —— (S)-tert-butyl 2-((2S,3S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxopentan-2-ylcarbamoyl)pyrrolidine-1-carboxylate 1287261-22-6 C35H47N5O9 681.786 —— tert-butyl (S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxobutan-2-ylcarbamate 1287261-07-7 C29H38N4O8 570.643 —— (S)-tert-butyl 2-((S)-7-(2-methoxy-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)pyrrolidine-1-carboxylate 1287261-39-5 C30H37N3O8 567.639 —— methyl 2-((S)-2-((S)-2-(tert-butoxycarbonylamino)propanoyl)-3-(4-methoxyphenylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-7-yloxy)acetate 1287261-42-0 C28H35N3O8 541.601 —— tert-butyl (2S,3S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxopentan-2-yl carbamate 1287261-04-4 C30H40N4O8 584.67 —— tert-butyl (S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-1-oxopentan-2-ylcarbamate 1287261-05-5 C30H40N4O8 584.67 —— tert-butyl (S)-1-((2S,3S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxopentan-2-ylamino)-3-methyl-1-oxobutan-2-ylcarbamate 1287261-23-7 C35H49N5O9 683.802 —— (S)-tert-butyl 2-((2S,3S)-1-((S)-7-(2-methoxy-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxopentan-2-ylcarbamoyl)pyrrolidine-1-carboxylate 1287261-51-1 C36H48N4O9 680.799 —— tert-butyl 4-((2S,3S)-1-((S)-7-(2-(hydroxyamino)-2-oxoethoxy)-3-(4-methoxyphenylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-3-methyl-1-oxopentan-2-ylcarbamoyl)piperidine-1-carboxylate 1287261-24-8 C36H49N5O9 695.813