Pyrrolo[3,4-c]pyrazole-5(1H)-carboxylic acid, 3-[(4-fluorobenzoyl)amino]-4,6-dihydro-6,6-dimethyl-, (1S)-2-(dimethylamino)-1-phenylethyl ester

• 常用名: Pyrrolo[3,4-c]pyrazole-5(1H)-carboxylic acid, 3-[(4-fluorobenzoyl)amino]-4,6-dihydro-6,6-dimethyl-, (1S)-2-(dimethylamino)-1-phenylethyl ester
• 英文名: Pyrrolo[3,4-c]pyrazole-5(1H)-carboxylic acid, 3-[(4-fluorobenzoyl)amino]-4,6-dihydro-6,6-dimethyl-, (1S)-2-(dimethylamino)-1-phenylethyl ester
• CAS号: 1026898-98-5
• 分子量: 465.5
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₅H₂₈FN₅O₃
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: Pyrrolo[3,4-c]pyrazole-5(1H)-carboxylic acid, 3-[(4-fluorobenzoyl)amino]-4,6-dihydro-6,6-dimethyl-, (1S)-2-(dimethylamino)-1-phenylethyl ester

物理化学性质

• 分子式: C₂₅H₂₈FN₅O₃
• 分子量: 465.5
• InChIKey: XFMZYCHKCPPZQW-HXUWFJFHSA-N
• SMILES: CN(C)CC(OC(=O)N1Cc2c(NC(=O)c3ccc(F)cc3)n[nH]c2C1(C)C)c1ccccc1

靶点实验

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实验名称：Metabolic stability in human liver microsomes assessed as extraction ratio 来源：ChEMBL 靶标：Liver microsomes External Id：CHEMBL2067015

实验名称：Octanol/buffer partition coefficient, log D of the compound at pH 7.4 来源：ChEMBL 靶标：N/A External Id：CHEMBL2067014

实验名称：Antitumor activity against human HCT116 cells xenografted in mouse assessed as tumor ... 来源：ChEMBL 靶标：HCT-116 External Id：CHEMBL2067459

实验名称：Efflux ratio of permeability from basolateral to apical side over apical to basolater... 来源：ChEMBL 靶标：Caco-2 External Id：CHEMBL2067018

实验名称：Antitumor activity against human HCT116 cells xenografted in mouse assessed as tumor ... 来源：ChEMBL 靶标：HCT-116 External Id：CHEMBL2067461

实验名称：Half life in rat at 5 mg/kg, iv and 10 mg/kg, po 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL2067466

实验名称：Oral bioavailability in rat at 10 mg/kg 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL2067467

实验名称：Clearance in rat at 5 mg/kg, iv and 10 mg/kg, po 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL2067464

实验名称：Volume of distribution at steady state in rat at 5 mg/kg, iv and 10 mg/kg, po 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL2067465

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