L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-
概要:L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-(CAS 757246-86-9)是一种化学化合物,分子式为C40H58N6O10,分子量为782.42 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。
6-[[(2S)-1-[[(2S)-1-[(2S,4R)-2-[[1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-4-(3,4-dihydro-1H-isoquinoline-2-carbonyloxy)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexanoic acid
又称:L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-, 6-[[(1S)-1-[[(1S)-1-[(2S,4R)-2-[1-[2-(cyclopropylamino)-2-oxo-acetyl]butylcarbamoyl]-4-(3,4-dihydro-1H-isoquinoline-2-carbonyloxy)pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamoyl]-2-methyl-propyl]amino]-6-oxo-hexanoic acid, 6-[[(2S)-1-[[(2S)-1-[(2S,4R)-2-[[1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-4-(3,4-dihydro-1H-isoquinoline-2-carbonyloxy)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexanoic acid, L-Prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[(cyclopropylamino)oxoacetyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)- (9CI), N-(5-Carboxypentanoyl)-L-valyl-L-valyl-(4R)-N-[1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-4-[(3,4-dihydroisoquinoline-2(1H)-carbonyl)oxy]-L-prolinamide
| 分子式 | C40H58N6O10 |
|---|---|
| 分子量 | 782.42 g/mol |
| LogP | 3.4 |
| 拓扑极性表面积 | 221.0 Ų |
| 氢键供体数 | 5 |
| 氢键受体数 | 10 |
| 可旋转键数 | 20 |
| 精确质量 | 782.42145 |
| 重原子数 | 56 |
| 复杂度 | 1450.0 |
化学标识符
| CAS 编号 | 757246-86-9 |
|---|---|
| SMILES | CCCC(C(=O)C(=O)NC1CC1)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CCCCC(=O)O)OC(=O)N3CCC4=CC=CC=C4C3 |
| InChIKey | KTOMWINXIOTJNM-FRBOYBKJSA-N |
产品概述
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-(CAS 757246-86-9),分子式为C40H58N6O10,分子量为782.42 g/mol。IUPAC名:6-[[(2S)-1-[[(2S)-1-[(2S,4R)-2-[[1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-4-(3,4-dihydro-1H-isoquinoline-2-carbonyloxy)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexanoic acid。
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-化学性质概览
属性洞察:L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的XLogP值为3.4,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221.0 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-有5个氢键供体和10个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的CAS号是多少?
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的CAS号为757246-86-9。
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的分子式是什么?
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的分子式为C40H58N6O10。
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的分子量是多少?
L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的分子量为782.42 g/mol。
在哪里可以购买L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-?
您可以直接向科弘生物询价L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-。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L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-的定制合成服务?
是的,科弘生物提供L-prolinamide, N-(5-carboxy-1-oxopentyl)-L-valyl-L-valyl-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]butyl]-4-[[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]oxy]-, (4R)-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。