3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one
概要：3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one（CAS 893698-56-1）是一种化学化合物，分子式为C33H31N3O5S2，分子量为613.17 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。
(4E)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
又称：3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-propoxyphenyl)pyrrolidine-2,3-dione, (4E)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
| 分子式 | C33H31N3O5S2 |
|---|---|
| 分子量 | 613.17 g/mol |
| LogP | 6.87732 |
| 拓扑极性表面积 | 101.85 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 9 |
| 可旋转键数 | 9 |
| 精确质量 | 613.17053 |
| 重原子数 | 43 |
| 复杂度 | 1715.7081 |
化学标识符
| CAS 编号 | 893698-56-1 |
|---|---|
| SMILES | CCCOC1=CC=CC(=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=C(C=C6)C |
产品概述
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one（CAS 893698-56-1），分子式为C33H31N3O5S2，分子量为613.17 g/mol。IUPAC名：(4E)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione。
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one化学性质概览
属性洞察：3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的XLogP值为6.87732，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101.85 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，3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one有1个氢键供体和9个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的CAS号是多少？
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的CAS号为893698-56-1。
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的分子式是什么？
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的分子式为C33H31N3O5S2。
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的分子量是多少？
3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的分子量为613.17 g/mol。
在哪里可以购买3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one？
您可以直接向科弘生物询价3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-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3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-1H-pyrrol-2(5H)-one的定制合成服务？
是的，科弘生物提供3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-5-(3-propoxyphenyl)-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。