5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one
概要:5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one(CAS 618855-47-3)是一种化学化合物,分子式为C35H25Cl2N3O6S2,分子量为717.06 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。
(4E)-1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione
又称:5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one, (4E)-1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione, (4E)-5-[3-(benzyloxy)phenyl]-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
| 分子式 | C35H25Cl2N3O6S2 |
|---|---|
| 分子量 | 717.06 g/mol |
| LogP | 8.1137 |
| 拓扑极性表面积 | 111.08 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 10 |
| 可旋转键数 | 9 |
| 精确质量 | 717.0562 |
| 重原子数 | 48 |
| 复杂度 | 2055.3728 |
化学标识符
| CAS 编号 | 618855-47-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NN=C(S4)SCC5=C(C=C(C=C5)Cl)Cl)C6=CC(=CC=C6)OCC7=CC=CC=C7)/O |
产品概述
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one(CAS 618855-47-3),分子式为C35H25Cl2N3O6S2,分子量为717.06 g/mol。IUPAC名:(4E)-1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione。
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one化学性质概览
属性洞察:5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的XLogP值为8.1137,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111.08 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,5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one有1个氢键供体和10个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的CAS号是多少?
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的CAS号为618855-47-3。
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的分子式是什么?
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的分子式为C35H25Cl2N3O6S2。
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的分子量是多少?
5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的分子量为717.06 g/mol。
在哪里可以购买5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
您可以直接向科弘生物询价5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one。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5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one的定制合成服务?
是的,科弘生物提供5-(3-(benzyloxy)phenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-1H-pyrrol-2(5H)-one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。