5-iodo-3',5'-di-O-p-toluyl-2'-deoxyuridine | 31356-86-2

分子结构分类

有机化合物 - 核苷、核苷酸和类似物 - 嘧啶核苷

中文名称

——

中文别名

——

英文名称

5-iodo-3',5'-di-O-p-toluyl-2'-deoxyuridine

英文别名

3',5'-di-O-p-toluoyl-5-iodo-2'-deoxyuridine；[(2R,3S,5R)-5-(5-iodo-2,4-dioxopyrimidin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate

5-iodo-3',5'-di-O-p-toluyl-2'-deoxyuridine化学式

CAS

31356-86-2

化学式

C₂₅H₂₃IN₂O₇

mdl

——

分子量

590.371

InChiKey

OENJVMKAWHZWNP-PWRODBHTSA-N

BEILSTEIN

——

EINECS

——

物化性质

熔点：

204.5-206 °C
密度：

1.65±0.1 g/cm3(Predicted)
溶解度：

可溶于氯仿、DCM、乙酸乙酯

计算性质

辛醇/水分配系数(LogP)：

3.7
重原子数：

35
可旋转键数：

8
环数：

4.0
sp3杂化的碳原子比例：

0.28
拓扑面积：

111
氢给体数：

1
氢受体数：

7

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
2'-脱氧-3',5'-二-O-(4-甲基苯甲酰)尿苷	2'-deoxy-3',5'-di-O-(4-methylbenzoyl)uridine	4449-38-1	C₂₅H₂₄N₂O₇	464.475
碘苷	5-Iodo-2'-deoxyuridine	54-42-2	C₉H₁₁IN₂O₅	354.101
2-脱氧尿苷	2'-Deoxyuridine	951-78-0	C₉H₁₂N₂O₅	228.205

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	3',5'-di-O-(p-toluoyl)-5-iodo-α-2'-desoxyuridine	104267-95-0	C₂₅H₂₃IN₂O₇	590.371
——	3',5'-di-O-p-toluoyl-5-ethenyl-2'-deoxyuridine	55520-65-5	C₂₇H₂₆N₂O₇	490.513
——	5-Ethynyl-3',5'-di-O-p-toluyl-2'-deoxyuridine	69075-43-0	C₂₇H₂₄N₂O₇	488.497
——	5-propynyl-3',5'-di-O-p-toluyl-2'-deoxyuridine	84558-92-9	C₂₈H₂₆N₂O₇	502.524
——	[(2R,3S,5R)-5-(5-but-1-ynyl-2,4-dioxopyrimidin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	77875-86-6	C₂₉H₂₈N₂O₇	516.551
——	5-(3-Hydroxypropynyl)-3',5'-di-O-p-toluyl-2'-deoxyuridine	85267-64-7	C₂₈H₂₆N₂O₈	518.523
——	[(2R,3S,5R)-5-(2,4-dioxo-5-pent-1-ynylpyrimidin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	77875-87-7	C₃₀H₃₀N₂O₇	530.577
——	5-Hexynyl-3',5'-di-O-p-toluyl-2'-deoxyuridine	77875-88-8	C₃₁H₃₂N₂O₇	544.604
——	5-(4-Hydroxybutynyl)-3',5'-di-O-p-toluyl-2'-deoxyuridine	85267-65-8	C₂₉H₂₈N₂O₈	532.55
——	5-(3-methoxypropynyl)-1-(3,5-di-O-p-toluyl-β-D-erythro-pentofuranosyl)uracil	84558-99-6	C₂₉H₂₈N₂O₈	532.55
——	5-[1-[(2R,4S,5R)-4-(4-methylbenzoyl)oxy-5-[(4-methylbenzoyl)oxymethyl]oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]pent-4-ynyl 4-methylbenzoate	77875-95-7	C₃₈H₃₆N₂O₉	664.712
——	[(2R,3S,5R)-5-[5-(3,3-dimethylbut-1-ynyl)-2,4-dioxopyrimidin-1-yl]-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	77875-90-2	C₃₁H₃₂N₂O₇	544.604
——	[(2R,3S,5R)-5-(5-hept-1-ynyl-2,4-dioxopyrimidin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	77875-89-9	C₃₂H₃₄N₂O₇	558.631
——	4-[1-[(2R,4S,5R)-4-(4-methylbenzoyl)oxy-5-[(4-methylbenzoyl)oxymethyl]oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]but-3-ynyl 4-methylbenzoate	77882-22-5	C₃₇H₃₄N₂O₉	650.685
——	[(2R,3S,5R)-5-[2,4-dioxo-5-(2-phenylethynyl)pyrimidin-1-yl]-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	77875-92-4	C₃₃H₂₈N₂O₇	564.595
——	[(2R,3S,5R)-5-[2,4-dioxo-5-[(E)-2-phenylethenyl]pyrimidin-1-yl]-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	125654-44-6	C₃₃H₃₀N₂O₇	566.61
——	5'-O-(4,4'-dimethoxytrityl)-5-iodo-α-2'-desoxyuridine	932047-57-9	C₃₀H₂₉IN₂O₇	656.474
——	[(2R,3S,5R)-5-[2,4-dioxo-5-[(E)-2-trimethylsilylethenyl]pyrimidin-1-yl]-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	125654-43-5	C₃₀H₃₄N₂O₇Si	562.695
——	[(2R,3S,5R)-5-[5-[(E)-3-ethoxy-3-oxoprop-1-enyl]-2,4-dioxopyrimidin-1-yl]-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate	99443-30-8	C₃₀H₃₀N₂O₉	562.576
——	5-ethynyltrimethylsilyl-3',5'-di-O-p-toluyl-2'-deoxyuridine	77875-91-3	C₃₀H₃₂N₂O₇Si	560.679
——	(2R,3S,5R)-5-(2,4-dioxo-5-((E)-3-((tetrahydro-2H-pyran-2-yl)oxy)prop-1-en-1-yl)-3,4-dihydropyrimidin-1(