benzyl 4-{(5S)-5-[(acetylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl}-2-fluorophenyl(benzyl)carbamate | 182059-57-0

分子结构分类

有机化合物 - 苯类化合物 - 苯和取代衍生物

中文名称

——

中文别名

——

英文名称

benzyl 4-{(5S)-5-[(acetylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl}-2-fluorophenyl(benzyl)carbamate

英文别名

(S)-benzyl-(4-(5-(acetamidomethyl)-2-oxo-3-oxazolidinyl)-2-fluorophenyl)benzylcarbamate；benzyl {4-[5(S)-(acetylaminomethyl)-2-oxo-oxazoIidin-3-yl]-2-flouro-phenyl}-benzyl-carbamate；benzyl N-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-benzylcarbamate

benzyl 4-{(5S)-5-[(acetylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl}-2-fluorophenyl(benzyl)carbamate化学式

CAS

182059-57-0

化学式

C₂₇H₂₆FN₃O₅

mdl

——

分子量

491.519

InChiKey

UZDMJQDCIQJVOQ-QHCPKHFHSA-N

BEILSTEIN

——

EINECS

——

物化性质

熔点：

64-66 °C
沸点：

700.2±60.0 °C(Predicted)
密度：

1.310±0.06 g/cm3(Predicted)

计算性质

辛醇/水分配系数(LogP)：

3.7
重原子数：

36
可旋转键数：

9
环数：

4.0
sp3杂化的碳原子比例：

0.22
拓扑面积：

88.2
氢给体数：

1
氢受体数：

6

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
——	benzyl 4-((S)-5-(aminomethyl)-2-oxooxazolidin-3-yl)-2-fluorophenylbenzylcarbamate	219664-23-0	C₂₅H₂₄FN₃O₄	449.482
——	benzyl-[4-(5-azidomethyl-2-oxo-oxazolidin-3-yl)-2-fluoro-phenyl]-carbamate	851529-79-8	C₂₅H₂₂FN₅O₄	475.479
——	benzyl benzyl{2-fluoro-4-[(5R)-5-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}carbamate	181997-30-8	C₂₅H₂₃FN₂O₅	450.466
——	benzyl benzyl(4-(((benzyloxy)carbonyl)amino)-2-fluorophenyl)carbamate	181997-29-5	C₂₉H₂₅FN₂O₄	484.527

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	(5S)-N-((3-(4-amino-3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl)methyl)acetamide	181997-31-9	C₁₂H₁₄FN₃O₃	267.26
——	N-{[(5S)-3-(3-fluoro-4-{[(2-formylhydrazino)carbothioyl]amino}phenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	266327-46-2	C₁₄H₁₆FN₅O₄S	369.377
——	N-{[(5S)-3-(3-fluoro-4-hydrazinophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	266327-72-4	C₁₂H₁₅FN₄O₃	282.275
——	N-{[(5S)-3-(4-azido-3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	181997-33-1	C₁₂H₁₂FN₅O₃	293.257
——	N-{[(5S)-3-(3-fluoro-4-isothiocyanatophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	181997-32-0	C₁₃H₁₂FN₃O₃S	309.321
——	N-[((5S)-3-{4-[2-(1-cyano-2-nitriloethylidene)hydrazino]-3-fluorophenyl}-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide	266327-85-9	C₁₅H₁₃FN₆O₃	344.305
——	N-({(5S)-3-[4-({[(5-benzyl-1,2,4-oxadiazol-3-yl)imino]methyl}amino)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl)acetamide	266327-97-3	C₂₂H₂₁FN₆O₄	452.445
——	N-{[(5S)-3-(4-{2-[(E)-3-ethoxy-2-propenoyl]hydrazino}-3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	——	C₁₇H₂₁FN₄O₅	380.376
——	N-[((5S)-3-{4-[2-(3,5-diamino-4H-pyrazol-4-ylidene)hydrazino]-3-fluorophenyl}-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide	266327-86-0	C₁₅H₁₇FN₈O₃	376.35
——	(S)-N-[3-[3-Fluoro-4-[4H-1,2,4-triazol-4-yl]phenyl]-2-oxo-5-oxazolidinyl]methylacetamide	——	C₁₄H₁₄FN₅O₃	319.295
——	(S)-N-[[3-[3-Fluoro-4-(3-hydroxymethyl-1H-pyrrol-1-yl)phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	——	C₁₇H₁₈FN₃O₄	347.346
——	N-{(S)-3-[3-fluoro-4-(3-formyl-pyrrol-1-yl)-phenyl]-2-oxo-oxazolidin-5-yl methyl}-acetamide	181996-88-3	C₁₇H₁₆FN₃O₄	345.33
——	(S)-N-[[3-[3-Fluoro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	——	C₁₃H₁₃FN₆O₃	320.283
——	(S)-N-[[3-[3-Fluoro-4-[3-(3-hydroxypropyl)-1H-pyrrol-1-yl]phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	181996-99-6	C₁₉H₂₂FN₃O₄	375.4
——	(S)-N-[[3-[3-Fluoro-4-(3-carbomethoxy-1H-pyrrol-1-yl)phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	181996-90-7	C₁₈H₁₈FN₃O₅	375.356
——	(S)-N-[[3-[4-[3-mercapto-4-[1,2,4]triazolyl]-3-fluorophenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	181996-85-0	C₁₄H₁₄FN₅O₃S	351.361
——	N-[[(5S)-3-[3-fluoro-4-(5-oxo-1H-pyrazol-2-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide	266327-76-8	C₁₅H₁₅FN₄O₄	334.307
——	(S)-N-[[3-[3-Fluoro-4-[3-(2-carboethoxyethyl)-1H-pyrrol-1-yl]phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	181996-98-5	C₂₁H₂₄FN₃O₅	417.437
——	(S)-N-[[3-[3-Fluoro-4-[3-(3-methanesulfonylaminopropyl)-1H-pyrrol-1-yl]phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	——	C₂₀H₂₅FN₄O₅S	452.507
——	(S)-N-[[3-[3-Fluoro-4-(4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl)phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide	——	C₁₅H₁₆FN₅O₄	349.322
——	N-[[(5S)-3-[4-(4-cyanotriazol-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide	——	C₁₅H₁₃FN₆O₃	344.305
——	N-[[(5S)-3-[3-fluoro-4-(4-formyltriazol-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide	181996-95-2	C₁₅H₁₄FN₅O₄	347.306
——	N-{[(5S)-3-(3-fluoro-4-{4-[(hydroxyimino)methyl]-1H-1,2,3-triazol-1-yl}phenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	——	C₁₅H₁₅FN₆O₄	362.32
——	N-{[(5S)-3-(3-fluoro-4-{5-[(E)-2-phenylethenyl]-2H-1,2,3,4-tetrazol-2-yl}phenyl)-2-oxo-1,3-oxazolan-5-yl]methyl}acetamide	266328-02-3	C₂₁H₁₉FN₆O₃	422.419
——	N-[[(5S)-3-[3-fluoro-4-(5-formyltetrazol-2-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide	266328-03-4	C₁₄H₁₃FN₆O₄	348.293