330796-24-2
中文名称
N-[4-Chloro-3-(trifluoromethyl)phenyl]-N'-[[3-(4-fluorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]methyl]urea
英文名称
N-[4-Chloro-3-(trifluoromethyl)phenyl]-N'-[[3-(4-fluorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]methyl]urea
CAS
330796-24-2
分子式
C23H15ClF4N4O2
分子量
490.84
MOL 文件
330796-24-2.mol
330796-24-2 结构式
基本信息
英文别名
Hedgehog Antagonist VIIHedgehog Antagonist VIII
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]methyl]urea
1-(4-chloro-3-trifluoroMethyl-phenyl)-3-[3-(4-fluoro-phenyl)-4-oxo-3,4-dihydro-quinazolin-2-ylMethyl]-urea
N-[4-Chloro-3-(trifluoromethyl)phenyl]-N'-[[3-(4-fluorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]methyl]urea
N-[4-Chloro-3-(trifluoromethyl)phenyl]-N’-[[3-(4-fluorophenyl)-3,4-dihydro\n-4-oxo-2-quinazolinyl]methyl]urea
Urea, N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-[[3-(4-fluorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]methyl]-
物理化学性质
密度1.46±0.1 g/cm3(Predicted)
储存条件-20°C储存
溶解度DMF: 30 mg/ml; DMF:PBS(pH7.2) (1:2): 0.3 mg/ml; DMSO: 25 mg/ml; Ethanol: 10 mg/ml
酸度系数(pKa)12.17±0.46(Predicted)
形态结晶固体
颜色clear slightly yellow
InChI1S/C23H15ClF4N4O2/c24-18-10-7-14(11-17(18)23(26,27)28)30-22(34)29-12-20-31-19-4-2-1-3-16(19)21(33)32(20)15-8-5-13(25)6-9-15/h1-11H,12H2,(H2,29,30,34)
InChIKeyNYOXUHUPXGFHIB-UHFFFAOYSA-N
SMILESFC(F)(F)c1c(ccc(c1)NC(=O)NCc2[n]([c](c4c(n2)cccc4)=O)c3ccc(cc3)F)Cl