4-chloro-2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)pyrido[2,3-d]pyrimidin-7(8H)-one | 911370-50-8

分子结构分类

有机化合物 - 有机杂环化合物 - 吡啶并嘧啶类

中文名称

——

中文别名

——

英文名称

4-chloro-2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)pyrido[2,3-d]pyrimidin-7(8H)-one

英文别名

4-chloro-2-[3-(diethylamino)propylamino]-8-(2,6-difluorophenyl)pyrido[2,3-d]pyrimidin-7-one

4-chloro-2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)pyrido[2,3-d]pyrimidin-7(8H)-one化学式

CAS

911370-50-8

化学式

C₂₀H₂₂ClF₂N₅O

mdl

——

分子量

421.877

InChiKey

PCZYVVBLACUWMS-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

562.0±60.0 °C(Predicted)
密度：

1.344±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

辛醇/水分配系数(LogP)：

4.3
重原子数：

29
可旋转键数：

8
环数：

3.0
sp3杂化的碳原子比例：

0.35
拓扑面积：

61.4
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
——	4-chloro-2-methylsulfanyl-8-(2,6-difluoro-phenyl)-8H-pyrido[2,3-d]pyrimidin-7-one	911110-48-0	C₁₄H₈ClF₂N₃OS	339.753
——	4-chloro-2-methylsulfinyl-8-(2,6-difiuoro-phenyl)-8H-pyrido[2,3-d]pyrimidin-7-one	911370-07-5	C₁₄H₈ClF₂N₃O₂S	355.752

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-benzoic acid	911370-57-5	C₂₇H₂₇F₂N₅O₃	507.54
——	4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(1-methylethyl)benzamide	——	C₃₀H₃₄F₂N₆O₂	548.636
——	4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-propylbenzamide	——	C₃₀H₃₄F₂N₆O₂	548.636
——	N-cyclopropyl-4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]benzamide	——	C₃₀H₃₂F₂N₆O₂	546.62
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-benzoic acid	911370-58-6	C₂₇H₂₇F₂N₅O₃	507.54
——	4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide	——	C₃₃H₃₁F₃N₆O₂	600.643
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-methylbenzamide	——	C₂₈H₃₀F₂N₆O₂	520.582
——	4-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-1,3-thiazol-2-ylbenzamide	——	C₃₀H₂₉F₂N₇O₂S	589.669
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(1-methylethyl)benzamide	——	C₃₀H₃₄F₂N₆O₂	548.636
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(1,1-dimethylethyl)benzamide	——	C₃₁H₃₆F₂N₆O₂	562.663
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-propylbenzamide	——	C₃₀H₃₄F₂N₆O₂	548.636
——	N-cyclopropyl-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]benzamide	——	C₃₀H₃₂F₂N₆O₂	546.62
——	N-cyclopentyl-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]benzamide	——	C₃₂H₃₆F₂N₆O₂	574.674
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-phenylbenzamide	——	C₃₃H₃₂F₂N₆O₂	582.653
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide	——	C₃₃H₃₁F₃N₆O₂	600.643
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-1,3-thiazol-2-ylbenzamide	——	C₃₀H₂₉F₂N₇O₂S	589.669
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methylbenzoic acid	911370-53-1	C₂₈H₂₉F₂N₅O₃	521.567
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methylbenzoic acid	911490-45-4	C₂₈H₂₈F₃N₅O₃	539.557
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methyl-N-propylbenzamide	——	C₃₁H₃₆F₂N₆O₂	562.663
——	N-(cyanomethyl)-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methylbenzamide	——	C₃₀H₃₁F₂N₇O₂	559.619
——	N-cyclopropyl-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methylbenzamide	——	C₃₁H₃₄F₂N₆O₂	560.647
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-N-4-dimethylbenzamide	——	C₂₉H₃₁F₃N₆O₂	552.599
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methyl-N-(2-methylpropyl)benzamide	——	C₃₂H₃₈F₂N₆O₂	576.69
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methyl-N-phenylbenzamide	——	C₃₄H₃₄F₂N₆O₂	596.68
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methyl-N-(1-methylethyl)benzamide	——	C₃₁H₃₅F₃N₆O₂	580.653
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(4-fluorophenyl)-2-methylbenzamide	——	C₃₄H₃₃F₃N₆O₂	614.67
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methyl-N-propylbenzamide	——	C₃₁H₃₅F₃N₆O₂	580.653
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-N-(1,1-dimethylethyl)-5-fluoro-4-methylbenzamide	——	C₃₂H₃₇F₃N₆O₂	594.68
——	1,1-dimethylethyl 3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methylbenzoate	——	C₃₂H₃₆F₃N₅O₃	595.665
——	N-cyclopropyl-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methylbenzamide	——	C₃₁H₃₃F₃N₆O₂	578.637
——	N-cyclopentyl-3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methylbenzamide	——	C₃₃H₃₇F₃N₆O₂	606.691
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methyl-N-phenylbenzamide	——	C₃₄H₃₃F₃N₆O₂	614.67
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-2-methyl-N-1,3-thiazol-2-ylbenzamide	——	C₃₁H₃₁F₂N₇O₂S	603.696
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-N-(4-fluorophenyl)-4-methylbenzamide	——	C₃₄H₃₂F₄N₆O₂	632.661
——	3-[2-{[3-(diethylamino)propyl]amino}-8-(2,6-difluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-5-fluoro-4-methyl-N-1,3-thiazol-2-ylbenzamide	——	C₃₁H₃₀F₃N₇O₂S	621.686