1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE
概要:1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE(CAS 797766-90-6)是一种化学化合物,分子式为C20H25N3O4S,分子量为403.16 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。
1-(2,2-dimethyloxan-4-yl)-4-(4-methoxyphenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione
又称:1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE, 1-(2,2-dimethyloxan-4-yl)-4-(4-methoxyphenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione, 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-4-(4-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-4-(4-methoxyphenyl)-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one, 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
| 分子式 | C20H25N3O4S |
|---|---|
| 分子量 | 403.16 g/mol |
| LogP | 3.0898 |
| 拓扑极性表面积 | 85.35 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 5 |
| 可旋转键数 | 3 |
| 精确质量 | 403.1566 |
| 重原子数 | 28 |
| 复杂度 | 931.9177 |
化学标识符
| CAS 编号 | 797766-90-6 |
|---|---|
| SMILES | CC1(CC(CCO1)N2C3=C(C(SCC(=O)N3)C4=CC=C(C=C4)OC)C(=O)N2)C |
产品概述
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE(CAS 797766-90-6),分子式为C20H25N3O4S,分子量为403.16 g/mol。IUPAC名:1-(2,2-dimethyloxan-4-yl)-4-(4-methoxyphenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione。
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE化学性质概览
属性洞察:1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的XLogP值为3.0898,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85.35 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,1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE有2个氢键供体和5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
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的CAS号是多少?
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的CAS号为797766-90-6。
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的分子式是什么?
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的分子式为C20H25N3O4S。
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的分子量是多少?
1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的分子量为403.16 g/mol。
在哪里可以购买1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE?
您可以直接向科弘生物询价1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-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1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE的定制合成服务?
是的,科弘生物提供1-(2,2-DIMETHYLOXAN-4-YL)-3-HYDROXY-4-(4-METHOXYPHENYL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-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。