![(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate structure](/static/products/799/799831-43-9.png)
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate
概要：(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate（CAS 799831-43-9）是一种化学化合物，分子式为C23H24F4N2O2S，分子量为468.15 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。
methyl (E)-3-[(Z)-cyano-(6,7-dimethylspiro[2,4-dihydroisoquinoline-3,1'-cyclohexane]-1-ylidene)methyl]sulfanyl-3-fluoro-2-(trifluoromethyl)prop-2-enoate
又称：(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate, methyl (2E)-3-{[(Z)-cyano(6',7'-dimethyl-2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)methyl]sulfanyl}-3-fluoro-2-(trifluoromethyl)prop-2-enoate, methyl (E)-3-[(Z)-cyano-(6,7-dimethylspiro[2,4-dihydroisoquinoline-3,1'-cyclohexane]-1-ylidene)methyl]sulfanyl-3-fluoro-2-(trifluoromethyl)prop-2-enoate
| 分子式 | C23H24F4N2O2S |
|---|---|
| 分子量 | 468.15 g/mol |
| LogP | 5.99382 |
| 拓扑极性表面积 | 62.12 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 5 |
| 可旋转键数 | 3 |
| 精确质量 | 468.14948 |
| 重原子数 | 32 |
| 复杂度 | 1031.6576 |
化学标识符
| CAS 编号 | 799831-43-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)/C(=C(\C#N)/S/C(=C(\C(=O)OC)/C(F)(F)F)/F)/NC3(C2)CCCCC3 |
产品概述
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate（CAS 799831-43-9），分子式为C23H24F4N2O2S，分子量为468.15 g/mol。IUPAC名：methyl (E)-3-[(Z)-cyano-(6,7-dimethylspiro[2,4-dihydroisoquinoline-3,1'-cyclohexane]-1-ylidene)methyl]sulfanyl-3-fluoro-2-(trifluoromethyl)prop-2-enoate。
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate化学性质概览
属性洞察：(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的XLogP值为5.99382，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62.12 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)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate有1个氢键供体和5个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的CAS号是多少？
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的CAS号为799831-43-9。
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的分子式是什么？
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的分子式为C23H24F4N2O2S。
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的分子量是多少？
(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的分子量为468.15 g/mol。
在哪里可以购买(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate？
您可以直接向科弘生物询价(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate。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)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate的定制合成服务？
是的，科弘生物提供(E)-methyl 3-(((Z)-cyano(6',7'-dimethyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-ylidene)methyl)thio)-3-fluoro-2-(trifluoromethyl)acrylate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。