[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methanol | 1443531-76-7

分子结构分类

有机化合物 - 有机杂环化合物 - 吡咯并三嗪类

中文名称

——

中文别名

——

英文名称

[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methanol

英文别名

US9598416, Example 32

[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methanol化学式

CAS

1443531-76-7

化学式

C₁₇H₁₆N₄O₂S

mdl

——

分子量

340.406

InChiKey

LQEHYBMFMNGCKY-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

2.2
重原子数：

24
可旋转键数：

3
环数：

4.0
sp3杂化的碳原子比例：

0.18
拓扑面积：

114
氢给体数：

2
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
——	(4-amino-5,7-dibromopyrrolo[2,1-f][1,2,4]triazin-6-yl)methanol	1443531-74-5	C₇H₆Br₂N₄O	321.959

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	6-(methoxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443531-77-8	C₁₈H₁₈N₄O₂S	354.433
——	6-(ethoxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443531-78-9	C₁₉H₂₀N₄O₂S	368.459
——	US9598416, Example 40	1443616-99-6	C₁₉H₁₇N₅O₂S	379.442
——	4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid	1443616-93-0	C₁₇H₁₄N₄O₃S	354.389
——	6-(Chloromethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443733-45-6	C₁₇H₁₅ClN₄OS	358.851
——	4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carbaldehyde	1443616-54-3	C₁₇H₁₄N₄O₂S	338.39
——	6-(azidomethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443616-53-2	C₁₇H₁₅N₇OS	365.418
——	N-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}acetamide	1443616-67-8	C₁₉H₁₉N₅O₂S	381.458
——	N²-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}glycinamide	1443616-75-8	C₁₉H₂₀N₆O₂S	396.473
——	N²-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}-N-methylglycinamide	1443616-71-4	C₂₀H₂₂N₆O₂S	410.5
——	rac-N²-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}alaninamide	1443616-70-3	C₂₀H₂₂N₆O₂S	410.5
——	N²-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6yl]methyl}-N²-methylglycinamide	1443616-72-5	C₂₀H₂₂N₆O₂S	410.5
——	US9598416, Example 46	1443617-05-7	C₂₁H₂₂N₆OS	406.511
——	1-(4-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}piperazin-1-yl)ethanone	1443616-80-5	C₂₃H₂₆N₆O₂S	450.564
——	4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide	1443616-94-1	C₁₇H₁₅N₅O₂S	353.404
——	5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-6-(morpholin-4-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443616-83-8	C₂₁H₂₃N₅O₂S	409.512
——	4-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methyl}piperazin-2-one	1443616-69-0	C₂₁H₂₂N₆O₂S	422.511
——	4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-N,N-dimethylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide	1443616-95-2	C₁₉H₁₉N₅O₂S	381.458
——	4-amino-N-ethyl-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide	1443616-96-3	C₁₉H₁₉N₅O₂S	381.458
——	1-(4-{[4-amino-6-(hydroxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f]-[1,2,4]triazin-7-yl]methyl}piperazin-1-yl)ethanone	1443530-78-6	C₂₄H₂₈N₆O₃S	480.591
——	[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(morpholin-4-ylmethyl)pyrrolo-[2,1-f][1,2,4]triazin-6-yl]methanol	1443530-73-1	C₂₂H₂₅N₅O₃S	439.538
——	4-{[4-amino-6-(hydroxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f]-[1,2,4]triazin-7-yl]methyl}piperazin-2-one	1443530-27-5	C₂₂H₂₄N₆O₃S	452.537
——	6-(ethoxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(piperazin-1-ylmethyl)-pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443530-33-3	C₂₄H₃₀N₆O₂S	466.607
——	[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-6-yl](4-methylpiperazin-1-yl)methanone	1443616-97-4	C₂₂H₂₄N₆O₂S	436.538
——	{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(piperazin-1-ylmethyl)pyrrolo[2,1-f]-[1,2,4]triazin-6-yl]methoxy}acetic acid	1443530-54-8	C₂₄H₂₈N₆O₄S	496.59
罗加替尼	4-{[4-amino-6-(methoxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-7-yl]methyl}piperazin-2-one	1443530-05-9	C₂₃H₂₆N₆O₃S	466.564
——	6-[(cyclobutyloxy)methyl]-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(piperazin-1-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine	1443530-45-7	C₂₆H₃₂N₆O₂S	492.645
——	methyl {[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(piperazin-1-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-6-yl]methoxy}acetate	1443530-53-7	C₂₅H₃₀N₆O₄S	510.617
——	2-{[4-amino-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)-7-(piperazin-1-ylmethyl)pyrrolo-[2,1-f][1,2,4]triazin-6-yl]methoxy}acetamide	1443530-55-9	C₂₄H₂₉N₇O₃S	495.605
——	1-(4-{[4-amino-6-(ethoxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f]-[1,2,4]triazin-7-yl]methyl}piperazin-1-yl)ethanone	1443530-35-5	C₂₆H₃₂N₆O₃S	508.644
——	tert-butyl 4-{[4-amino-6-(hydroxymethyl)-5-(7-methoxy-5-methyl-1-benzothiophen-2-yl)pyrrolo[2,1-f][1,2,4]triazin-7-yl]methyl}piperazine-1-carboxylate	1443531-79-0	C₂₇H₃₄N₆O₄S	538.671