(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
概要:(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one(CAS 896075-81-3)是一种化学化合物,分子式为C21H18N6O3S3,分子量为498.06 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。
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
又称:(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one, (6E)-5-imino-3-[(2-methylpropyl)sulfonyl]-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one, (E)-5-imino-3-(isobutylsulfonyl)-6-((6-phenylimidazo[2,1-b]thiazol-5-yl)methylene)-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7(6H)-one
| 分子式 | C21H18N6O3S3 |
|---|---|
| 分子量 | 498.06 g/mol |
| LogP | 3.71027 |
| 拓扑极性表面积 | 120.32 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 8 |
| 可旋转键数 | 4 |
| 精确质量 | 498.06024 |
| 重原子数 | 33 |
| 复杂度 | 1496.2378 |
化学标识符
| CAS 编号 | 896075-81-3 |
|---|---|
| SMILES | CC(C)CS(=O)(=O)C1=NSC2=NC(=O)/C(=C/C3=C(N=C4N3C=CS4)C5=CC=CC=C5)/C(=N)N21 |
产品概述
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one(CAS 896075-81-3),分子式为C21H18N6O3S3,分子量为498.06 g/mol。IUPAC名:(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one。
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one化学性质概览
属性洞察:(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的XLogP值为3.71027,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120.32 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,(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one有1个氢键供体和8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
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的CAS号是多少?
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的CAS号为896075-81-3。
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的分子式是什么?
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的分子式为C21H18N6O3S3。
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的分子量是多少?
(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的分子量为498.06 g/mol。
在哪里可以购买(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one?
您可以直接向科弘生物询价(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-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(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one的定制合成服务?
是的,科弘生物提供(6E)-5-imino-3-(2-methylpropylsulfonyl)-6-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylidene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-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。