(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-
概要:(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-(CAS 151227-08-6)是一种化学化合物,分子式为C20H19ClN2O3S,分子量为402.08 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。
(3R)-N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-[1]benzothiolo[2,3-c]pyridine-3-carboxamide;hydrochloride
又称:(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-, (1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (R)-, (4R)-N-(2H-1,3-Benzodioxol-5-ylmethyl)-8-thia-5-azatricyclo(7.4.0.0(2,7))trideca-1(9),2(7),10,12-tetraene-4-carboxamide hydrochloride, (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-[1]benzothiolo[2,3-c]pyridine-3-carboxamide;hydrochloride, (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydrobenzothiopheno[2,3-c]pyridine-3-carboxamide;hydrochloride
| 分子式 | C20H19ClN2O3S |
|---|---|
| 分子量 | 402.08 g/mol |
| LogP | 3.3825 |
| 拓扑极性表面积 | 59.59 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 5 |
| 可旋转键数 | 3 |
| 精确质量 | 402.0805 |
| 重原子数 | 27 |
| 复杂度 | 1004.05554 |
化学标识符
| CAS 编号 | 151227-08-6 |
|---|---|
| SMILES | C1[C@@H](NCC2=C1C3=CC=CC=C3S2)C(=O)NCC4=CC5=C(C=C4)OCO5.Cl |
产品概述
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-(CAS 151227-08-6),分子式为C20H19ClN2O3S,分子量为402.08 g/mol。IUPAC名:(3R)-N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-[1]benzothiolo[2,3-c]pyridine-3-carboxamide;hydrochloride。
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-化学性质概览
属性洞察:(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的XLogP值为3.3825,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。 (1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的拓扑极性表面积(TPSA)为59.59 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-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)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的CAS号是多少?
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的CAS号为151227-08-6。
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的分子式是什么?
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的分子式为C20H19ClN2O3S。
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的分子量是多少?
(1)Benzothieno(2,3-C)pyridine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3R)-的分子量为402.08 g/mol。
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