2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester
概要:2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester(CAS 352317-05-6)是一种化学化合物,分子式为C19H26F3N3O4S,分子量为449.16 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。
ethyl 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3,3-trifluoro-2-(3-methylbutanoylamino)propanoate
又称:2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester, ethyl 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3,3-trifluoro-2-(3-methylbutanoylamino)propanoate, ethyl N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-[(3-methylbutanoyl)amino]alaninate, 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3,3-trifluoro-2-[(3-methyl-1-oxobutyl)amino]propanoic acid ethyl ester, 2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3,3,3-trifluoro-2-(isovalerylamino)propionic acid ethyl ester
| 分子式 | C19H26F3N3O4S |
|---|---|
| 分子量 | 449.16 g/mol |
| LogP | 3.1217 |
| 拓扑极性表面积 | 110.52 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 6 |
| 可旋转键数 | 8 |
| 精确质量 | 449.1596 |
| 重原子数 | 30 |
| 复杂度 | 822.682 |
化学标识符
| CAS 编号 | 352317-05-6 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C(=O)N)NC(=O)CC(C)C |
产品概述
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester(CAS 352317-05-6),分子式为C19H26F3N3O4S,分子量为449.16 g/mol。IUPAC名:ethyl 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3,3-trifluoro-2-(3-methylbutanoylamino)propanoate。
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester化学性质概览
属性洞察:2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的XLogP值为3.1217,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110.52 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-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester有3个氢键供体和6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-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的CAS号是多少?
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的CAS号为352317-05-6。
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的分子式是什么?
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的分子式为C19H26F3N3O4S。
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的分子量是多少?
2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的分子量为449.16 g/mol。
在哪里可以购买2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester?
您可以直接向科弘生物询价2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester。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-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester的定制合成服务?
是的,科弘生物提供2-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-ylamino)-3,3,3-trifluoro-2-(3-methyl-butyrylamin o)-propionic acid ethyl ester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。