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L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )

更新时间:2026-07-26 18:35:39

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式
L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式
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常用名 L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl ) 英文名 L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )
CAS号 71074-45-8 分子量 543.57700
密度 1.414g/cm3 沸点 N/A
分子式 C27H29N9O4 熔点 N/A
MSDS N/A 闪点 N/A

 名称

本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。

英文名 5-(benzylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid

 物理化学性质

本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。

密度 1.414g/cm3
分子式 C27H29N9O4
分子量 543.57700
精确质量 543.23400
PSA 202.34000
LogP 3.44440
InChIKey MXDDHQREZRYBOV-UHFFFAOYSA-N
SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)NCc2ccccc2)C(=O)O)cc1
折射率 1.71

 合成线路

本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。

~88%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Rosowsky, Andre; Forsch, Ronald; Uren, Jack; Wick, Michael Journal of Medicinal Chemistry, 1981 , vol. 24, # 12 p. 1450 - 1455

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Piper; Montgomery; Sirotnak; Chello Journal of Medicinal Chemistry, 1982 , vol. 25, # 2 p. 182 - 187

~%

L-Glutamine, N(2)-[4-[[(2, 4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-(phenylmethyl )结构式

L-Glutamine, N(...

71074-45-8

查看详情
文献:Rosowsky, Andre; Forsch, Ronald; Uren, Jack; Wick, Michael Journal of Medicinal Chemistry, 1981 , vol. 24, # 12 p. 1450 - 1455

 靶点实验

查看更多实验

本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。

实验名称:Ratio of compound ID50 relative to methotrexate against dihydrofolate reductase by co...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL667757
实验名称:Ratio of compound ID50 relative to methotrexate, against Lactobacillus casei dihydrof...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL667758
实验名称:Ratio of compound ID50 relative to methotrexate, against Lactobacillus casei dihydrof...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL668387
实验名称:Compound was tested for inhibition of L1210 dihydrofolate reductase by competitive [3...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL669318
实验名称:Inhibition of Dihydrofolate reductase in mouse L1210 cells
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL667316
实验名称:The compound was compared with MTX with respect to cytotoxicity toward H.Ep.-2 cells.
来源:ChEMBL
靶标:NON-PROTEIN TARGET
External Id:CHEMBL849762
实验名称:Compound was tested for inhibition of Lactobacillus casei dihydrofolate reductase usi...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL664724
实验名称:Compound was tested for inhibition of Lactobacillus casei dihydrofolate reductase usi...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL664725
实验名称:Growth inhibitory activity against L1210 mouse leukemia cell line
来源:ChEMBL
靶标:L1210
External Id:CHEMBL703207
实验名称:Percent increase in life span was measured against L1210 murine leukemia cells at the...
来源:ChEMBL
靶标:L1210
External Id:CHEMBL707310
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 常见问题

本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。

Q: 71074-45-8的CAS号是多少?
A: 71074-45-8CAS号为71074-45-8。
Q: 71074-45-8的上游原料有哪些?
A: 71074-45-8相关上游原料(CAS):79640-80-5;10541-83-0;13030-09-6;2528-30-5;66891-86-9;79974-07-5;19741-14-1。
Q: 71074-45-8的InChIKey是什么?
A: 71074-45-8InChIKey为MXDDHQREZRYBOV-UHFFFAOYSA-N。
Q: 71074-45-8的分子量是多少?
A: 71074-45-8分子量为543.57700。
Q: 71074-45-8的分子式是什么?
A: 71074-45-8分子式为C27H29N9O4。
Q: 71074-45-8的中文名称是什么?
A: 71074-45-8的中文名称为71074-45-8。
Q: 71074-45-8的极性表面积PSA是多少?
A: 71074-45-8极性表面积PSA为202.34000。
Q: 71074-45-8的SMILES表达式是什么?
A: 71074-45-8SMILES表达式为CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)NCc2ccccc2)C(=O)O)cc1。
Q: 71074-45-8的英文名称是什么?
A: 71074-45-8英文名称为5-(benzylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid。
Q: 71074-45-8的LogP(油水分配系数)是多少?
A: 71074-45-8LogP(油水分配系数)为3.44440。
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