4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate
概要:4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate(CAS 342788-86-7)是一种化学化合物,分子式为C21H14BrN3O5,分子量为467.01 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-[(E)-[(3-nitrobenzoyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate
又称:BIM-0021231.P001, 4-(2-{3-nitrobenzoyl}carbohydrazonoyl)phenyl 4-bromobenzoate, (E)-4-((2-(3-nitrobenzoyl)hydrazono)methyl)phenyl 4-bromobenzoate, 4-(2-(3-NITROBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-BROMOBENZOATE, 4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate
| 分子式 | C21H14BrN3O5 |
|---|---|
| 分子量 | 467.01 g/mol |
| LogP | 4.3404 |
| 拓扑极性表面积 | 110.9 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 6 |
| 精确质量 | 467.0117 |
| 重原子数 | 30 |
| 复杂度 | 1112.2456 |
化学标识符
| CAS 编号 | 342788-86-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br |
产品概述
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate(CAS 342788-86-7),分子式为C21H14BrN3O5,分子量为467.01 g/mol。IUPAC名:[4-[(E)-[(3-nitrobenzoyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate。
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate化学性质概览
属性洞察:4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的XLogP值为4.3404,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110.9 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-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate有1个氢键供体和6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-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的CAS号是多少?
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的CAS号为342788-86-7。
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的分子式是什么?
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的分子式为C21H14BrN3O5。
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的分子量是多少?
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的分子量为467.01 g/mol。
在哪里可以购买4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate?
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科弘生物是否提供4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate的定制合成服务?
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