![Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester structure](/static/products/7317/731780-89-5.webp)
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester
概要：Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester（CAS 731780-89-5）是一种化学化合物，分子式为C30H28F2N4O4，分子量为546.21 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。
[2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
又称：Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester, [2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-[(4-dimethylaminophenyl)diazenyl]benzoate
| 分子式 | C30H28F2N4O4 |
|---|---|
| 分子量 | 546.21 g/mol |
| LogP | 7.21664 |
| 拓扑极性表面积 | 85.49 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 7 |
| 可旋转键数 | 10 |
| 精确质量 | 546.2079 |
| 重原子数 | 40 |
| 复杂度 | 1528.5614 |
化学标识符
| CAS 编号 | 731780-89-5 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)OC(F)F)C)C(=O)COC(=O)C3=CC=CC=C3N=NC4=CC=C(C=C4)N(C)C |
产品概述
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester（CAS 731780-89-5），分子式为C30H28F2N4O4，分子量为546.21 g/mol。IUPAC名：[2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate。
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester化学性质概览
属性洞察：Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的XLogP值为7.21664，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85.49 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，Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester有0个氢键供体和7个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的CAS号是多少？
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的CAS号为731780-89-5。
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的分子式是什么？
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的分子式为C30H28F2N4O4。
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的分子量是多少？
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester的分子量为546.21 g/mol。
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您可以直接向科弘生物询价Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl ester。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
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