Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate
概要:Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate(CAS 27420-81-1)是一种化学化合物,分子式为C13H17Br2N3O2,分子量为404.97 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。
methyl N-[[4-[bis(2-bromoethyl)amino]phenyl]methylideneamino]carbamate
又称:methyl N-[[4-[bis(2-bromoethyl)amino]phenyl]methylideneamino, Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate, Hydrazinecarboxylicacid, 2-[[4-[bis(2-bromoethyl)amino]phenyl]methylene]-, methyl ester
| 分子式 | C13H17Br2N3O2 |
|---|---|
| 分子量 | 404.97 g/mol |
| LogP | 3.2 |
| 拓扑极性表面积 | 53.9 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 8 |
| 精确质量 | 404.96875 |
| 重原子数 | 20 |
| 复杂度 | 302.0 |
化学标识符
| CAS 编号 | 27420-81-1 |
|---|---|
| SMILES | COC(=O)NN=CC1=CC=C(C=C1)N(CCBr)CCBr |
| InChIKey | LLVSITIGYYTPHY-UHFFFAOYSA-N |
产品概述
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate(CAS 27420-81-1),分子式为C13H17Br2N3O2,分子量为404.97 g/mol。IUPAC名:methyl N-[[4-[bis(2-bromoethyl)amino]phenyl]methylideneamino]carbamate。
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate化学性质概览
属性洞察:Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的XLogP值为3.2,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。 Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的拓扑极性表面积(TPSA)为53.9 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate有1个氢键供体和4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
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的CAS号是多少?
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的CAS号为27420-81-1。
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的分子式是什么?
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的分子式为C13H17Br2N3O2。
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的分子量是多少?
Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate的分子量为404.97 g/mol。
在哪里可以购买Methyl 2-({4-[bis(2-bromoethyl)amino]phenyl}methylidene)hydrazine-1-carboxylate?
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