rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate
概要:rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate(CAS 2639391-77-6)是一种化学化合物,分子式为C12H14F5N3O2,分子量为327.10 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。
ethyl (5S,7S)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
又称:rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate, ethyl (5S,7S)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
| 分子式 | C12H14F5N3O2 |
|---|---|
| 分子量 | 327.10 g/mol |
| LogP | 3.0026 |
| 拓扑极性表面积 | 56.15 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 3 |
| 精确质量 | 327.10062 |
| 重原子数 | 22 |
| 复杂度 | 569.5982 |
化学标识符
| CAS 编号 | 2639391-77-6 |
|---|---|
| SMILES | CCOC(=O)C1=NN2[C@@H](C[C@@H](NC2=C1)C)C(C(F)(F)F)(F)F |
产品概述
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate(CAS 2639391-77-6),分子式为C12H14F5N3O2,分子量为327.10 g/mol。IUPAC名:ethyl (5S,7S)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate。
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate化学性质概览
属性洞察:rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的XLogP值为3.0026,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。 rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的拓扑极性表面积(TPSA)为56.15 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate有1个氢键供体和4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
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的CAS号是多少?
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的CAS号为2639391-77-6。
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的分子式是什么?
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的分子式为C12H14F5N3O2。
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的分子量是多少?
rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的分子量为327.10 g/mol。
在哪里可以购买rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate?
您可以直接向科弘生物询价rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate。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rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate的定制合成服务?
是的,科弘生物提供rac-ethyl (5R,7R)-5-methyl-7-(1,1,2,2,2-pentafluoroethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxylate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。