[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate
概要:[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate(CAS 502729-89-7)是一种化学化合物,分子式为C21H16ClN3O5S,分子量为457.05 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-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 2-methylsulfanylpyridine-3-carboxylate
又称:[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate, [(4-chloro-3-nitrophenyl)carbamoyl](phenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate, [2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 2-methylsulfanylpyridine-3-carboxylate
| 分子式 | C21H16ClN3O5S |
|---|---|
| 分子量 | 457.05 g/mol |
| LogP | 4.9019 |
| 拓扑极性表面积 | 111.43 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 7 |
| 可旋转键数 | 7 |
| 精确质量 | 457.04993 |
| 重原子数 | 31 |
| 复杂度 | 1127.0079 |
化学标识符
| CAS 编号 | 502729-89-7 |
|---|---|
| SMILES | CSC1=C(C=CC=N1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
产品概述
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate(CAS 502729-89-7),分子式为C21H16ClN3O5S,分子量为457.05 g/mol。IUPAC名:[2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 2-methylsulfanylpyridine-3-carboxylate。
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate化学性质概览
属性洞察:[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的XLogP值为4.9019,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111.43 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-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate有1个氢键供体和7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-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的CAS号是多少?
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的CAS号为502729-89-7。
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的分子式是什么?
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的分子式为C21H16ClN3O5S。
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的分子量是多少?
[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的分子量为457.05 g/mol。
在哪里可以购买[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate?
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科弘生物是否提供[(4-chloro-3-nitro-phenyl)carbamoyl-phenyl-methyl] 2-methylsulfanylpyridine-3-carboxylate的定制合成服务?
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