CAS: 169396-92-3; 2-(N-(2-((((9H-Fluoren-9-yl)Methoxy)Carbonyl)Amino)Ethyl)-2-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-yl)Acetamido)Acetic Acid

英文名称2-(N-(2-((((9H-Fluoren-9-yl)Methoxy)Carbonyl)Amino)Ethyl)-2-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-yl)Acetamido)Acetic Acid
中文名称PNA-胸腺嘧啶单体
IUPAC名称N-(2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)ethyl)-N-(2-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl)glycine
其它别名Glycine, N-[2-(3,4-Dihydro-5-Methyl-2,4-Dioxo-1(2H)-Pyrimidinyl)Acetyl]-N-[2-[[(9H-Fluoren-9-Ylmethoxy)Carbonyl]Amino]Ethyl]-; 2-[n-[2-(Fmoc-Amino)Ethyl]-2-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-yl)Acetamido]Acetic Acid; 2-{n-[2-({[(9H-Fluoren-9-yl)Methoxy]Carbonyl}Amino)Ethyl]-2-(5-Methyl-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidin-1-yl)Acetamido}Acetic Acid; 4-Dihydro-5-Methyl-2; 4-Dioxo-1(2H)-Pyrimidinyl)Acetyl]-N-[2-[[(9H-Fluoren-9-Ylmethoxy)Carbonyl]Amino]Ethyl]-; N-(N-Fmoc-2-Aminoethyl)-N-[(1-Thyminylacetyl)]Glycine; {[2-(9H-Fluoren-9-Ylmethoxycarbonylamino)-Ethyl]-[2-(5-Methyl-2,4-Dioxo-3,4-Dihydro-2H-Pyrimidin-1-yl)-Acetyl]-Amino}-Acetic Acid; Fmoc-Pna-T-Oh
CAS编号169396-92-3
MFCD编号:MFCD01940758
分子式:C26H26N4O7分子量:506.51
产品CID: 856466
产品分类生物化工 → 氨基酸及其衍生物 → 甘氨酸类衍生物

相似结构搜索
InChIKey: REUYSHQBEXUIRY-UHFFFAOYSA-N
REUYSHQBEXUIRY-UHFFFAOYSA-N
计算化学: 氢键受体数7.0氢键供体数3.0可旋转键数10.0

物理性质

密度1.368±0.06 g/cm3(预测)
pKa:3.33±0.10(预测)
PSA:150.8
LogP:1.6878
外观形态固体;White to Light yellow powder to crystal
储存条件-20°C;存放于惰性气体之中;避免空气,加热
产品应用该化合物用于该化合物用于检测病原体中的药物抗药性.

MSDS等安全信息

警示词Warning
危险描述H315-H319-
防范说明P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-

上下游产品

methyl N-[2-(fluorenylmethoxycarbonyl)aminoethyl]-N-[(thymine-1-yl)acetyl]glycinate N-(9H-fluoren-2-ylmethoxycarbonyloxy)succinimide N-(2-t-butoxycarbonylaminoethyl)-N-(thymin-1-ylacetyl)glycine thymidyl acetic acidH-fluoren-9-ylmethoxycarbonylamino)-ethyl]-[(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-acetyl]-amino}-acetylamino)-pyridin-3-ylmethyl]-[(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-acetyl]-amino}-acetic acid benzyl ester{[4-(2-{[2-(9H-fluoren-9-ylmethoxycarbonylamino)-ethyl]-[(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-acetyl]-amino}-acetylamino)-pyridin-3-ylmethyl]-[(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-acetyl]-amino}-acetic acid benzyl ester 48H52N8O13C48H52N8O13 115H150N38O40SC115H150N38O40S

合成工艺路线路线简述

📜胸腺嘧啶-1-乙酸置于sodium Hydroxide,O-<[cyano(Ethoxycarbonyl)Methylene]Amino>-1,1,3,3-Tetramethyluronium Tetrafluoroborate,9-芴甲基-N-琥珀酰亚胺基碳酸酯,N,N-二异丙基乙胺体系中,用 N,N-二甲基甲酰胺用作溶剂,化学反应 3.75H,反应生成Pna-胸腺嘧啶单体
参考文献:Synthesis Of Polyamide Nucleic Acids (Pnas) Using A Novel Fmoc/mmt Protecting-Group Combination
标题:Synthesis Of Polyamide Nucleic Acids (Pnas) Using A Novel Fmoc/mmt Protecting-Group Combination
摘要:The Preparation Of 9-Fluorenylmethoxycarbonyl(Fmoc) Protected Building Blocks For The Synthesis Of Polyamide Nucleic Acids (Pnas) Is Described. Use Of 4-Methoxyphenyldiphenylmethyl (Mmt)-Protecting Groups For The Exocyclic Amino Function Of The Nucleobases Enhances The Solubility Of The Monomers And Allows Final Deprotection By Mild Acid Treatment. The Novel Synthetic Route Is Exemplified By The Synthesis Of Heptameric And octameric Pnas.
Doi:10.1016/0960-894X(96)00082-0