(3R,4R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-[4-(t-butoxycarbonylmethoxy)phenyl]azetidin-2-one | 858104-48-0

分子结构分类

有机化合物 - 有机杂环化合物 - 内酰胺类

中文名称

——

中文别名

——

英文名称

(3R,4R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-[4-(t-butoxycarbonylmethoxy)phenyl]azetidin-2-one

英文别名

tert-butyl (4-{(2R,3R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-oxoazetidin-2-yl}phenoxy)acetate；{4-[(2R,3R)-1-(4-fluoro-phenyl)-3-(3-nitro-pyridin-2-yldisulfanyl)-4-oxo-azetidin-2-yl]-phenoxy}-acetic acid tert-butyl ester；tert-butyl 2-[4-[(2R,3R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)disulfanyl]-4-oxoazetidin-2-yl]phenoxy]acetate

(3R,4R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-[4-(t-butoxycarbonylmethoxy)phenyl]azetidin-2-one化学式

CAS

858104-48-0

化学式

C₂₆H₂₄FN₃O₆S₂

mdl

——

分子量

557.623

InChiKey

IZTUWTRVPFPENB-DHIUTWEWSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

5
重原子数：

38
可旋转键数：

10
环数：

4.0
sp3杂化的碳原子比例：

0.27
拓扑面积：

165
氢给体数：

0
氢受体数：

10

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
——	(3R,4R)-1-(4-fluorophenyl)-3-(4-methoxybenzylsulphanyl)-4-[4-(t-butoxycarbonylmethoxy)phenyl]azetidin-2-one	858104-47-9	C₂₉H₃₀FNO₅S	523.625
——	tert-butyl (4-{(1R)-1-[(4-fluorophenyl)amino]-2-[(4-methoxybenzyl)thio]-3-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl}phenoxy)acetate	858104-46-8	C₃₈H₃₉FN₂O₇S	686.801

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	(4-{(2R,3R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-oxoazetidin-2-yl}phenoxy)acetic acid	917886-96-5	C₂₂H₁₆FN₃O₆S₂	501.516
——	N-[(4-{(2R,3R)-1-(4-fluorophenyl)-3-[(3-nitropyridin-2-yl)dithio]-4-oxoazetidin-2-yl}phenoxy)acetyl]glycyl-3-methyl-D-valine	917886-78-3	C₃₀H₃₀FN₅O₈S₂	671.727
——	{4-[(2R,3R)-3-[2-(2,3-dihydro-benzofuran-6-yl)-2-oxo-ethylsulfanyl]-1-(4-fluoro-phenyl)-4-oxo-azetidin-2-yl]-phenoxy}-acetic acid tert-butyl ester	917815-18-0	C₃₁H₃₀FNO₆S	563.647
——	{4-[(2R,3R)-3-{[2-(4-ethoxyphenyl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	858108-32-4	C₂₇H₂₄FNO₆S	509.555
——	(4-{(2R,3R)-1-(4-fluoro-phenyl)-3-[(RS)-2-(4-fluoro-phenyl)-2-oxoethylsulfanyl]-4-oxo-azetidin-2-yl}-phenoxy)-acetic acid	858104-50-4	C₂₅H₁₉F₂NO₅S	483.492
——	{4-[(2R,3R)-1-(4-fluorophenyl)-3-({2-hydroxy-2-[4-(methylthio)phenyl]ethyl}thio)-4-oxoazetidin-2-yl]phenoxy}acetic acid	858108-30-2	C₂₆H₂₄FNO₅S₂	513.611
——	{4-[(2R,3R)-3-{[2-(4-tert-butylphenyl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	858104-41-3	C₂₉H₂₈FNO₅S	521.609
——	{4-[(2R,3R)-3-{[2-(2,3-dihydro-1-benzofuran-5-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	917814-86-9	C₂₇H₂₂FNO₆S	507.539
——	{4-[(2R,3R)-3-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	917577-58-3	C₂₇H₂₂FNO₇S	523.539
——	[4-((2R,3R)-1-(4-fluorophenyl)-4-oxo-3-{[2-oxo-2-(4-pentylphenyl)ethyl]thio}azetidin-2-yl)phenoxy]acetic acid	858104-33-3	C₃₀H₃₀FNO₅S	535.636
——	{4-[(2R,3R)-3-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	917886-80-7	C₂₆H₂₀FNO₇S	509.512
——	{4-[(2R,3R)-3-{[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	917602-87-0	C₂₈H₂₄FNO₅S	505.567
——	tert-butyl N-({4-[(2R,3R)-3-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetyl)glycinate	917886-97-6	C₃₂H₃₁FN₂O₈S	622.671
——	(3R,4R)-1-(4-fluorophenyl)-3-[(4-fluorobenzoyl)methylthio]-4-{4-[N-(carboxymethyl)carbamoylmethoxy]phenyl}azetidin-2-one	858104-55-9	C₂₇H₂₂F₂N₂O₆S	540.544
——	{4-[(2R,3R)-3-{[2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetic acid	917886-82-9	C₂₆H₂₂FNO₇S	511.528
——	{4-[(2R,3R)-3-[2-(2,3-dihydro-benzofuran-6-yl)-2-oxo-ethylsulfanyl]-1-(4-fluoro-phenyl)-4-oxo-azetidin-2-yl]-phenoxy}-acetic acid	917815-08-8	C₂₇H₂₂FNO₆S	507.539
——	N-({4-[(2R,3R)-3-{[2-(2,3-dihydro-1-benzofuran-5-yl)-2-oxoethyl]thio}-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy}acetyl)glycine	917814-89-2	C₂₉H₂₅FN₂O₇S	564.591
——	N-{[4-((2R,3R)-1-(4-fluorophenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]thio}-4-oxoazetidin-2-yl)phenoxy]acetyl}-L-alanine	858104-02-6	C₂₈H₂₄F₂N₂O₆S	554.571
——	N-{[4-((2R,3R)-1-(4-fluorophenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]thio}-4-oxoazetidin-2-yl)phenoxy]acetyl}-D-alanine	858103-90-9	C₂₈H₂₄F₂N₂O₆S	554.571
——	N-{[4-((2R,3R)-1-(4-fluorophenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]thio}-4-oxoazetidin-2-yl)phenoxy]acetyl}glycyl-L-asparagine	858103-97-6	C₃₁H₂₈F₂N₄O₈S	654.648
——	N-{[4-((2R,3R)-1-(4-fluorophenyl)-3-{[2-(4-fluorophenyl)-2-hydroxyethyl]thio}-4-oxoazetidin-2-yl)phenoxy]acetyl}-D-alanine	858104-62-8	C₂₈H₂₆F₂N₂O₆S	556.587
——	1-(4-fluorophenyl)-3-(R)-[(4-fluorobenzoyl)methylthio]-4-(R)-{4-[N-(α-(R)-{N-[2-(t-butoxy)-(1S)-(t-butoxycarbonyl)ethyl]carbamoyl}benzyl)carbamoylmethoxy]phenyl}azetidin-2-one	858104-52-6	C₄₄H₄₇F₂N₃O₈S	815.935
——	(2R)-({[4-((2R,3R)-1-(4-fluorophenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]thio}-4-oxoazetidin-2-yl)phenoxy]acetyl}amino)(phenyl)acetic acid	858103-93-2	C₃₃H₂₆F₂N₂O₆S	616.642