4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoic acid

• 常用名: 4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoic acid
• 英文名: 4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoic acid
• CAS号: 101248-32-2
• 分子量: 348.35500
• 密度: 1.33g/cm3
• 沸点: 652ºC at 760 mmHg
• 分子式: C₁₉H₁₆N₄O₃
• 熔点: N/A
• 闪点: 348.1ºC

名称

• 英文名: 4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoic acid

物理化学性质

• 密度: 1.33g/cm3
• 沸点: 652ºC at 760 mmHg
• 分子式: C₁₉H₁₆N₄O₃
• 分子量: 348.35500
• 闪点: 348.1ºC
• 精确质量: 348.12200
• PSA: 113.30000
• LogP: 2.18570
• InChIKey: UZTMEKSOOJWLIX-UHFFFAOYSA-N
• SMILES: C#CCN(Cc1ccc2nc(N)[nH]c(=O)c2c1)c1ccc(C(=O)O)cc1
• 蒸汽压: 6.88E-18mmHg at 25°C
• 折射率: 1.664

靶点实验

查看更多实验

实验名称：Inverse relative potency for the inhibition of L1210 thymidylate synthase 来源：ChEMBL 靶标：Thymidylate synthase External Id：CHEMBL817564

实验名称：Inhibitory dose for L1210 cells in culture. Not tested at higher concentrations becau... 来源：ChEMBL 靶标：L1210 External Id：CHEMBL707012

共2条，当前第1页，共1页

1

英文别名

• Benzoic acid,4-(((2-amino-1,4-dihydro-4-oxo-6-quinazolinyl)methyl)-2-propynylamino)
• 4-{N-[(2-amino-4-hydroxy-6-quinazolinyl)methyl]prop-2-ynylamino}benzoic acid
• N10-propargyl-5,8-dideazapteroic acid
• p-[N-(2-amino-3,4-dihydro-4-oxoquinazolin-6-ylmethyl)-N-(prop-2-ynyl)amino]benzoic acid
• 4-(((2-amino-3,4-dihydro-4-oxo-6-quinazolinyl)methyl) (2-propynyl)amino)benzoic acid