4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile
概要:4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile(CAS 839685-39-1)是一种化学化合物,分子式为C18H12ClN3O3,分子量为353.06 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)oxy-3-methoxybenzonitrile
又称:4-[(5-chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile, 4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)oxy-3-methoxybenzonitrile,
4-[(5-chloro-6-oxo-1-phenyl-1,6-dihydro-4-pyridazinyl)oxy]-3-methoxybenzoni trile, 4-((5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy)-3-methoxybenzonitrile, 4-(5-chloro-6-oxo-1-phenylhydropyridazin-4-yloxy)-3-methoxybenzenecarbonitrile
| 分子式 | C18H12ClN3O3 |
|---|---|
| 分子量 | 353.06 g/mol |
| LogP | 3.55848 |
| 拓扑极性表面积 | 77.14 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 5 |
| 可旋转键数 | 4 |
| 精确质量 | 353.05673 |
| 重原子数 | 25 |
| 复杂度 | 1010.31024 |
化学标识符
| CAS 编号 | 839685-39-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C#N)OC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl |
产品概述
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile(CAS 839685-39-1),分子式为C18H12ClN3O3,分子量为353.06 g/mol。IUPAC名:4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)oxy-3-methoxybenzonitrile。
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile化学性质概览
属性洞察:4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的XLogP值为3.55848,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 TPSA为77.14 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile有0个氢键供体和5个氢键受体,均在类药范围内,提示具有较好的口服生物利用度潜力。
常见问题
常见问题
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的CAS号是多少?
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的CAS号为839685-39-1。
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的分子式是什么?
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的分子式为C18H12ClN3O3。
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的分子量是多少?
4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile的分子量为353.06 g/mol。
在哪里可以购买4-[(5-Chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)oxy]-3-methoxybenzonitrile?
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