N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺结构式
|
常用名 | N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺 | 英文名 | BCTC |
|---|---|---|---|---|
| CAS号 | 393514-24-4 | 分子量 | 372.892 | |
| 密度 | 1.2±0.1 g/cm3 | 沸点 | 561.6±50.0 °C at 760 mmHg | |
| 分子式 | C20H25ClN4O | 熔点 | N/A | |
| MSDS | 中文版 美版 | 闪点 | 293.4±30.1 °C | |
| 符号 |
GHS07 |
信号词 | Warning |
用途BCTC作用于前列腺癌 (PCa) DU145细胞,有效且特异性抑制瞬时受体阳离子通道M成员8(TRPM8)。 |
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。
| 中文名 | N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺 |
|---|---|
| 英文名 | N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl)piperazine-1-carboxamide |
| 英文别名 | 更多 |
本表记录该化合物相关生物活性、作用靶点、活性说明与生物实验相关数据。
| 描述 | BCTC作用于前列腺癌 (PCa) DU145细胞,有效且特异性抑制瞬时受体阳离子通道M成员8(TRPM8)。 |
|---|---|
| 相关类别 | |
| 参考文献 |
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 | 1.2±0.1 g/cm3 |
|---|---|
| 沸点 | 561.6±50.0 °C at 760 mmHg |
| 分子式 | C20H25ClN4O |
| 分子量 | 372.892 |
| 闪点 | 293.4±30.1 °C |
| 精确质量 | 372.171692 |
| PSA | 48.47000 |
| LogP | 4.08 |
| InChIKey | ROGUAPYLUCHQGK-UHFFFAOYSA-N |
| SMILES | CC(C)(C)c1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cc1 |
| 蒸汽压 | 0.0±1.5 mmHg at 25°C |
| 折射率 | 1.610 |
| 储存条件 | 2-8℃ |
本表为化学品安全说明书MSDS数据,包含危险标识、成分、急救、消防、泄漏处置、操作储存等安全信息。
本表为该化合物相关公开文献,包含文献标题、期刊、发表信息等参考资料。
|
Polysulfide evokes acute pain through the activation of nociceptive TRPA1 in mouse sensory neurons.
Mol. Pain 11 , 24, (2015) Hydrogen sulfide (H2S) is oxidized to polysulfide. Recent reports show that this sulfur compound modulates various biological functions. We have reported that H2S is involved in inflammatory pain in m... |
|
|
Agonist-dependent modulation of cell surface expression of the cold receptor TRPM8.
J. Neurosci. 35(2) , 571-82, (2015) The spatial and temporal distribution of receptors constitutes an important mechanism for controlling the magnitude of cellular responses. Several members of the transient receptor potential (TRP) ion... |
|
|
Temperature oscillations drive cycles in the activity of MMP-2,9 secreted by a human trabecular meshwork cell line.
Invest. Ophthalmol. Vis. Sci. 56(2) , 1396-405, (2015) Aqueous humor inflow falls 50% during sleeping hours without proportional fall in IOP, partly reflecting reduced outflow facility. The mechanisms underlying outflow facility cycling are unknown. One o... |
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:Antagonist activity at human TRPV1 expressed in HEK cells assessed as inhibition of 1...
来源:ChEMBL
靶标:Transient receptor potential cation channel subfamily V member 1
External Id:CHEMBL4775810
|
|
实验名称:Primary qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinase 1 (...
来源:NCGC
External Id:IP6K1-p1
|
|
实验名称:Inhibition of 5-LOX (unknown origin)
来源:ChEMBL
靶标:Polyunsaturated fatty acid 5-lipoxygenase
External Id:CHEMBL5239814
|
|
实验名称:Inhibition of human vanilloid receptor 1 in HEK293 cells in pH 5.5-induced FLIPR assa...
来源:ChEMBL
靶标:Transient receptor potential cation channel subfamily V member 1
External Id:CHEMBL827822
|
|
实验名称:Inhibition of TRPV1 (unknown origin)
来源:ChEMBL
靶标:Transient receptor potential cation channel subfamily V member 1
External Id:CHEMBL5239815
|
|
实验名称:Cytochrome P450 family 3 subfamily A member 4 (CYP3A4) small molecule antagonists: lu...
来源:NCGC
External Id:CYP3A4437
|
|
实验名称:Cytochrome P450 family 2 subfamily D member 6 (CYP2D6) small molecule antagonists: lu...
来源:NCGC
External Id:CYP2D6395
|
|
实验名称:Inhibition of COX1 (unknown origin)
来源:ChEMBL
靶标:Prostaglandin G/H synthase 1
External Id:CHEMBL5239812
|
|
实验名称:Hypoglycemic activity against ICR mouse assessed as decrease in blood glucose at 20 m...
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL5552041
|
|
实验名称:Inhibition of human TRPV1 expressed in HEK293 cells assessed as reduction in capsaici...
来源:ChEMBL
靶标:Transient receptor potential cation channel subfamily V member 1
External Id:CHEMBL4235541
|
本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl)piperazine-1-carboxamide |
| 4-(3-Chloro-2-pyridinyl)-N-[4-(2-methyl-2-propanyl)phenyl]-1-piperazinecarboxamide |
| bctc |
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: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的英文名称是什么? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺英文名称为N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl)piperazine-1-carboxamide。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的LogP(油水分配系数)是多少? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺LogP(油水分配系数)为4.08。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的极性表面积PSA是多少? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺极性表面积PSA为48.47000。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺有什么用途? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺主要用途:BCTC作用于前列腺癌 (PCa) DU145细胞,有效且特异性抑制瞬时受体阳离子通道M成员8(TRPM8)。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的分子量是多少? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺分子量为372.892。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的沸点是多少? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺沸点为561.6±50.0 °C at 760 mmHg。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的InChIKey是什么? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺InChIKey为ROGUAPYLUCHQGK-UHFFFAOYSA-N。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的SMILES表达式是什么? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺SMILES表达式为CC(C)(C)c1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cc1。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的CAS号是多少? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺CAS号为393514-24-4。 |
| Q: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺的储存条件是什么? |
| A: N-(4-叔丁苯基)-4-(3-氯吡啶-2-基)哌嗪-1-甲酰胺储存条件:2-8℃。 |
本表列出该化合物相关生产厂商、供应商信息,包含厂家名称、产品供应相关参考信息。
| 上海阿拉丁生化科技股份有限公司 |
| 上海化源世纪贸易有限公司 |