(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate
概要:(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate(CAS 455300-59-1)是一种化学化合物,分子式为C27H22F2N4O3,分子量为488.17 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-[3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-oxoethyl] pyrazine-2-carboxylate
又称:(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate, [2-[3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-oxoethyl] pyrazine-2-carboxylate, 2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate
| 分子式 | C27H22F2N4O3 |
|---|---|
| 分子量 | 488.17 g/mol |
| LogP | 4.7348 |
| 拓扑极性表面积 | 84.75 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 6 |
| 可旋转键数 | 5 |
| 精确质量 | 488.166 |
| 重原子数 | 36 |
| 复杂度 | 1325.3894 |
化学标识符
| CAS 编号 | 455300-59-1 |
|---|---|
| SMILES | C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)F)C1)C(=O)COC(=O)C4=NC=CN=C4)C5=CC=C(C=C5)F |
产品概述
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate(CAS 455300-59-1),分子式为C27H22F2N4O3,分子量为488.17 g/mol。IUPAC名:[2-[3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-oxoethyl] pyrazine-2-carboxylate。
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate化学性质概览
属性洞察:(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的XLogP值为4.7348,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84.75 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,(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate有0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
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的CAS号是多少?
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的CAS号为455300-59-1。
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的分子式是什么?
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的分子式为C27H22F2N4O3。
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的分子量是多少?
(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的分子量为488.17 g/mol。
在哪里可以购买(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate?
您可以直接向科弘生物询价(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate的定制合成服务?
是的,科弘生物提供(E)-2-(7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)-2-oxoethyl pyrazine-2-carboxylate及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。