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原料药中间体

原料药中间体是指在药物合成过程中用于生成最终活性成分(即原料药)的化学物质。这些中间体在制药工业中扮演着重要角色,它们通过一系列化学反应逐步转化成成品药物。根据其在生产过程中的位置和功能,可以将原料药中间体分为以下几个类别:

  1. 起始物料:这类中间体是最初用于合成最终产品的原材料。它们通常来源于天然产物、化工产品或其他已经存在的化合物。

  2. 关键中间体:这些中间体在整个合成过程中起着核心作用,通常是通过复杂的化学反应得到的。它们对于确保原料药的质量和成本效益至关重要。

  3. 保护基团:在药物合成中使用这类中间体是为了对某些敏感部分进行临时性或选择性的“保护”,防止它们在不必要的位置上发生副反应。保护完成后可通过特定条件去除这些保护基。

  4. 催化剂和添加剂:虽然不直接形成最终产品,但这些物质能够促进化学反应、提高产率或改善产品的质量特性。

  5. 分离纯化溶剂:这类中间体主要用于原料药合成过程中的提纯步骤。它们帮助从目标产物中去除杂质并提高产品的纯度。

选择合适的原料药中间体对于保证药物的安全性和有效性至关重要,因此,在其开发过程中需要考虑多个因素,包括成本效益、反应条件的可控性以及环境友好型等方面。

下级分类

中文名称 英文名称 CAS号 化学式 结构式图片
(-)-3-(三氟乙酰基)樟脑 (+)-3-(trifluoroacetyl)camphor 207742-84-5 C12H15F3O2
(-)-3-(三氟乙酰基)樟脑
(-)-(S)-3-氧代环戊烷羧酸 (-)-(S)-3-oxocyclopentanecarboxylic acid 71830-06-3 C6H8O3
(-)-(S)-3-氧代环戊烷羧酸
(-)-(3Ar,6ar)-3a,6a-二氢-2,2-二甲基-4H-环戊并-1,3-二氧代-4-酮 (3aR,6aR)-2,2-Dimethyl-3a,6a-dihydro-cyclopenta[1,3]dioxol-4-one 115509-13-2 C8H10O3
(-)-(3Ar,6ar)-3a,6a-二氢-2,2-二甲基-4H-环戊并-1,3-二氧代-4-酮
(+/-)-1-苄氧羰基-4-Boc-哌嗪-2-羧酸甲酯 1-benzyl 4-(tert-butyl) 2-methyl piperazine-1,2,4-tricarboxylate 126937-42-6 C19H26N2O6
(+/-)-1-苄氧羰基-4-Boc-哌嗪-2-羧酸甲酯
(+/-)-1-(1,3-苯并二氧戊环-5-基)-2-溴-1-戊酮 1-(benzo[d]-1,3-dioxol-5-yl)-2-bromopentan-1-one 146721-06-4 C12H13BrO3
(+/-)-1-(1,3-苯并二氧戊环-5-基)-2-溴-1-戊酮
(+)-3-溴樟脑 (1R)-3-endo-bromocamphor 10293-06-8 C10H15BrO
(+)-3-溴樟脑
(+)-(1S,2R)-米那普仑 (1S,2R)-2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxamide 96847-54-0 C15H22N2O
(+)-(1S,2R)-米那普仑
()-N-(四氢-2,5-二氧代-3-呋喃基)乙酰胺 <i>N</i>-acetyl-<i>DL</i>-aspartic acid-anhydride 3397-54-4 C6H7NO4
()-N-(四氢-2,5-二氧代-3-呋喃基)乙酰胺
((5-噻唑基)甲基)-(4-硝基苯基)碳酸酯盐酸盐 4-nitrophenyl (5-thiazolyl)methyl carbonate hydrochloride 154212-59-6 C11H8N2O5S*ClH
((5-噻唑基)甲基)-(4-硝基苯基)碳酸酯盐酸盐
((5-噻唑基)甲基)-(4-硝基苯基)碳酸酯 4-nitrophenyl (thiazol-5-ylmethyl) carbonate 144163-97-3 C11H8N2O5S
((5-噻唑基)甲基)-(4-硝基苯基)碳酸酯
((4-羟基丁基)氮杂二基)双(己烷-6,1-二基)双(2-己基癸酸酯) ALC-0315 2036272-55-4 C48H95NO5
((4-羟基丁基)氮杂二基)双(己烷-6,1-二基)双(2-己基癸酸酯)
((3aR,4S,6aS)-5-乙酰氧基-2-氧代六氢-2H-环戊并[b]呋喃-4-基)甲基 乙酸酯 ((3aR,4S,5R,6aS)-5-acetoxy-2-oxohexahydro-2H-cyclopenta[b]furan-4-yl)methyl acetate 62939-82-6 C12H16O6
((3aR,4S,6aS)-5-乙酰氧基-2-氧代六氢-2H-环戊并[b]呋喃-4-基)甲基 乙酸酯
((3R,4S)-3-氟哌啶-4-基)氨基甲酸叔丁酯 tert-butyl N-[(3R,4S)-3-fluoropiperidin-4-yl]carbamate 1630815-57-4 C10H19FN2O2
((3R,4S)-3-氟哌啶-4-基)氨基甲酸叔丁酯
((3AR,4R,6R,6AR)-6-(4-(羟氨)-2-恶嘧啶-1(2H)-甲基)-2,2-二甲基四氢呋喃[3,4-D][1,3]二氧醇-4-基)异丁酸甲酯 molnupiravir acetonide 2346620-55-9 C16H23N3O7
((3AR,4R,6R,6AR)-6-(4-(羟氨)-2-恶嘧啶-1(2H)-甲基)-2,2-二甲基四氢呋喃[3,4-D][1,3]二氧醇-4-基)异丁酸甲酯
((2S)-2-氨基丙基)氨基甲酸叔丁酯 tert-butyl (S)-(2-aminopropyl)carbamate 121103-15-9 C8H18N2O2
((2S)-2-氨基丙基)氨基甲酸叔丁酯
((2R,3r,4r)-3-((4-氯苯甲酰基)氧基)-4-氟-4-甲基-5-氧代四氢呋喃-2-基)甲基4-氯苯甲酸 ((2R,3R,4R) 3-(4-chlorobenzoyloxy)-4-fluoro-4-methyl-5-oxotetrahydrofuran-2-yl)methyl-4-chlorobenzoate 1294481-79-0 C20H15Cl2FO6
((2R,3r,4r)-3-((4-氯苯甲酰基)氧基)-4-氟-4-甲基-5-氧代四氢呋喃-2-基)甲基4-氯苯甲酸
((2R,3R,4R)-3-(苯甲酰氧基)-4-氟-4-甲基-5-氧代四氢呋喃-2-基)苯甲酸甲酯 ((2R,3R,4R)-3-benzoyloxy-4-fluoro-4-methyl-5-oxo-tetrahydrofuran-2-yl)methyl benzoate 874638-80-9 C20H17FO6
((2R,3R,4R)-3-(苯甲酰氧基)-4-氟-4-甲基-5-氧代四氢呋喃-2-基)苯甲酸甲酯
((1R,3R,4R)-3-羟基-4-甲基环己基)氨基甲酸叔丁酯 tert-butyl ((1R,3R,4R)-3-hydroxy-4-methylcyclohexyl)carbamate 1403864-94-7 C12H23NO3
((1R,3R,4R)-3-羟基-4-甲基环己基)氨基甲酸叔丁酯
((1R,2S)-2-氨基环己基)氨基甲酸叔丁酯 tert-butyl ((1R,2S)-2-aminocyclohexyl)carbamate 364385-54-6 C11H22N2O2
((1R,2S)-2-氨基环己基)氨基甲酸叔丁酯
((1R,2R)-2-羟基-1-羟甲基-2-苯基乙基)氨基甲酸叔丁酯 ((1R,2R)-2-hydroxy-1-hydroxymethyl-2-phenylethyl)carbamic acid tert-butyl ester 1009093-14-4 C14H21NO4
((1R,2R)-2-羟基-1-羟甲基-2-苯基乙基)氨基甲酸叔丁酯
—— (3-bromophenyl)dimethylphosphine oxide 60398-84-7 C8H10BrOP
(3-bromophenyl)dimethylphosphine oxide
—— 1-((trans)-4-methylcyclohexyl)ethanone 18446-90-7 C9H16O
1-((trans)-4-methylcyclohexyl)ethanone
—— 4-chloro-N-((R)-1-((1s,4S)-4-(6-fluoroquinolin-4-yl)cyclohexyl)ethyl)benzamide 1923844-48-7 C24H24ClFN2O
4-chloro-N-((R)-1-((1s,4S)-4-(6-fluoroquinolin-4-yl)cyclohexyl)ethyl)benzamide
—— N-(4-((6-azidohexyloxy)diphenylsilyloxy)butyl)-1-(5-((3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl)-pentanamido)-3,6,9,12-tetraoxapentadecan-15-amide 1260247-50-4 C43H67N7O9SSi
N-(4-((6-azidohexyloxy)diphenylsilyloxy)butyl)-1-(5-((3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl)-pentanamido)-3,6,9,12-tetraoxapentadecan-15-amide
—— bis(4-bromophenyl)phosphine oxide 15754-53-7 C12H9Br2OP
bis(4-bromophenyl)phosphine oxide
—— 5-(2-chloroacetamido)-2,4,6-triiodo-N,N'-bis(2,3-bis(2-chloroacetoxy)propyl)isophthalamide 155887-14-2 C24H23Cl5I3N3O11
5-(2-chloroacetamido)-2,4,6-triiodo-N,N'-bis(2,3-bis(2-chloroacetoxy)propyl)isophthalamide
—— Pubchem_57369830 70431-34-4 C11H21NNa3O7+3
Pubchem_57369830
—— sulfopin 2451481-08-4 C11H20ClNO3S
sulfopin
—— 17-Alpha-cyano-9-alpha,17-beta-dihydroxyandrost-4-en-3-one 116256-35-0 C20H27NO3
17-Alpha-cyano-9-alpha,17-beta-dihydroxyandrost-4-en-3-one
—— Gpl23NZ2Q9 2061897-68-3 C34H38N4O5
Gpl23NZ2Q9
—— TERT-BUTYL TRANS-4-AMINOCYCLOHEXYLMETHYLCARBAMATE 192323-07-2 C12H24N2O2
TERT-BUTYL TRANS-4-AMINOCYCLOHEXYLMETHYLCARBAMATE
—— trans-4-((tert-butyldimethylsilyl)oxy)cyclohexane-1-carboxylic acid 955401-29-3 C13H26O3Si
trans-4-((tert-butyldimethylsilyl)oxy)cyclohexane-1-carboxylic acid
—— (1<i>RS</i>:2<i>SR</i>:3<i>RS</i>)-pinanediol-(2.3) 18680-27-8 C10H18O2
(1<i>RS</i>:2<i>SR</i>:3<i>RS</i>)-pinanediol-(2.3)
—— 2-cyano-5-iodopyrimidine 1083329-46-7 C5H2IN3
2-cyano-5-iodopyrimidine
—— 9,9-dipropylfluorene-2,7-dicarboxylic acid 204265-35-0 C21H22O4
9,9-dipropylfluorene-2,7-dicarboxylic acid
—— 3,4-Methylenedioxy-N-benzylcathinone (hydrochloride) 1823274-68-5 C17H18ClNO3
3,4-Methylenedioxy-N-benzylcathinone (hydrochloride)
—— Bicyclo[2.2.1]heptan-2-one,7,7-trimethyl-, (1R)- 10293-06-8 C10H15BrO
Bicyclo[2.2.1]heptan-2-one,7,7-trimethyl-, (1R)-
—— Neptinib 2085843-51-0 C22H23ClFN5O2
Neptinib
—— (S)-2-bromo-1-(4-chlorophenyl)ethanol 179065-35-1 C8H8BrClO
(S)-2-bromo-1-(4-chlorophenyl)ethanol
—— 2-(3-bromo-4-methylphenyl)propan-2-ol 1345961-02-5 C16H25BO3
2-(3-bromo-4-methylphenyl)propan-2-ol
—— DOTA-cyclo-RGDfK 909024-55-1 C43H67N13O14
DOTA-cyclo-RGDfK
—— Sodium;5-amino-8-phenyldiazenylnaphthalene-2-sulfonic acid 6300-23-8 C16H13N3NaO3S+
Sodium;5-amino-8-phenyldiazenylnaphthalene-2-sulfonic acid
—— N-(o-Benzyloxy-benzoyl)-glycin-aethylester 68939-33-3 C17H17NO4
N-(o-Benzyloxy-benzoyl)-glycin-aethylester
—— filgotinib maleate 1802998-75-9 C4H4O4*C21H23N5O3S
filgotinib maleate
—— 3-Cyclopropylcyclohexan-1-amine hydrochloride 1354952-79-6 C9H18ClN
3-Cyclopropylcyclohexan-1-amine hydrochloride
—— (R)-4-benzyl-3-((3S,5R)-5-(2,4-difluorophenyl)-5-(iodomethyl)tetrahydrofuran-3-carbonyl)oxazolidin-2-one 165115-89-9 C22H20F2INO4
(R)-4-benzyl-3-((3S,5R)-5-(2,4-difluorophenyl)-5-(iodomethyl)tetrahydrofuran-3-carbonyl)oxazolidin-2-one
—— 5-Chloro-3-sulfamoylthiophene-2-carboxylic acid 1017791-22-8 C5H4ClNO4S2
5-Chloro-3-sulfamoylthiophene-2-carboxylic acid
—— Halobetasol Dipropionate 886204-51-9 C28H35ClF2O6
Halobetasol Dipropionate
—— 5-ethylamino-4-methyl-1,2-benzoquinone-2-oxime 174909-38-7 C9H12N2O2
5-ethylamino-4-methyl-1,2-benzoquinone-2-oxime
—— 1-[4-(pyridin-2-yl)phenyl]-4(S)-hydroxy-5(S)-2,5-diamino-6-phenyl-2-azahexane trihydrochloride 198904-87-9 C22H26N4O*3ClH
1-[4-(pyridin-2-yl)phenyl]-4(S)-hydroxy-5(S)-2,5-diamino-6-phenyl-2-azahexane trihydrochloride