2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone
概要:2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone(CAS 850902-29-3)是一种化学化合物,分子式为C21H27N5O2S3,分子量为477.13 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。
2-[(14,14-dimethyl-7-propan-2-ylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-pyrrolidin-1-ylethanone
又称:2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone, 2-{[10,10-dimethyl-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
| 分子式 | C21H27N5O2S3 |
|---|---|
| 分子量 | 477.13 g/mol |
| LogP | 4.4053 |
| 拓扑极性表面积 | 72.62 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 8 |
| 可旋转键数 | 5 |
| 精确质量 | 477.1327 |
| 重原子数 | 31 |
| 复杂度 | 1147.2415 |
化学标识符
| CAS 编号 | 850902-29-3 |
|---|---|
| SMILES | CC(C)SC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N41)SCC(=O)N5CCCC5 |
产品概述
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone(CAS 850902-29-3),分子式为C21H27N5O2S3,分子量为477.13 g/mol。IUPAC名:2-[(14,14-dimethyl-7-propan-2-ylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-pyrrolidin-1-ylethanone。
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone化学性质概览
属性洞察:2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的XLogP值为4.4053,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72.62 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,2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone有0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
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的CAS号是多少?
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的CAS号为850902-29-3。
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的分子式是什么?
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的分子式为C21H27N5O2S3。
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的分子量是多少?
2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的分子量为477.13 g/mol。
在哪里可以购买2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
您可以直接向科弘生物询价2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone。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2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone的定制合成服务?
是的,科弘生物提供2-((5-(isopropylthio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone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。