![3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide structure](/static/products/1473/147318-81-8.webp)
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide
概要：3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide（CAS 147318-81-8）是一种化学化合物，分子式为C33H41N5O6S2，分子量为667.25 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。
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide
N-tert-butyl-3-[2-hydroxy-3-[[2-[(2-isoquinolin-5-yloxyacetyl)amino]-3-methylsulfanylpropanoyl]amino]-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide
又称：Kynostatin 272, Kynostatin 272 [MeSH], KNI 272; Kynostatin; NSC 651714, 3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide, N-tert-butyl-3-[2-hydroxy-3-[[2-[(2-isoquinolin-5-yloxyacetyl)amino]-3-methylsulfanylpropanoyl]amino]-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide
| 分子式 | C33H41N5O6S2 |
|---|---|
| 分子量 | 667.25 g/mol |
| LogP | 3.2 |
| 拓扑极性表面积 | 201.0 Ų |
| 氢键供体数 | 4 |
| 氢键受体数 | 9 |
| 可旋转键数 | 14 |
| 精确质量 | 667.2498 |
| 重原子数 | 46 |
| 复杂度 | 1040.0 |
化学标识符
| CAS 编号 | 147318-81-8 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1CSCN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)C(CSC)NC(=O)COC3=CC=CC4=C3C=CN=C4)O |
| InChIKey | NJBBLOIWMSYVCQ-UHFFFAOYSA-N |
专利应用标签
基于SureChEMBL全球专利数据库中2个IPC专利分类衍生。
产品概述
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide（CAS 147318-81-8），分子式为C33H41N5O6S2，分子量为667.25 g/mol。IUPAC名：N-tert-butyl-3-[2-hydroxy-3-[[2-[(2-isoquinolin-5-yloxyacetyl)amino]-3-methylsulfanylpropanoyl]amino]-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide。
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide化学性质概览
属性洞察：3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide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。 TPSA为201.0 Ų，极性较高，提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则，3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide有4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-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的CAS号是多少？
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的CAS号为147318-81-8。
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的分子式是什么？
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的分子式为C33H41N5O6S2。
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的分子量是多少？
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的分子量为667.25 g/mol。
在哪里可以购买3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide？
您可以直接向科弘生物询价3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide。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-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide的定制合成服务？
是的，科弘生物提供3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide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。