2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-
概要：2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-（CAS 158628-72-9）是一种化学化合物，分子式为C40H54N6O5S2，分子量为762.36 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。
1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[2-methylpropyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate
又称：2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-, 1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[2-methylpropyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate, 2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-[[2-(1-methylethyl)-4-thiazolyl]methyl]-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, [3S-(3R*,4R*,6R*,9R*)]-, N-[(2S,4S,5S)-4-Hydroxy-1,6-diphenyl-5-({[(1,3-thiazol-5-yl)methoxy]carbonyl}amino)hexan-2-yl]-N~2~-[(2-methylpropyl){[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl}carbamoyl]-L-valinamide, n-[(2s,4s,5s)-4-hydroxy-1,6-diphenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}hexan-2-yl]-n2-[(2-methylpropyl){[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl}carbamoyl]-l-valinamide
| 分子式 | C40H54N6O5S2 |
|---|---|
| 分子量 | 762.36 g/mol |
| LogP | 7.4 |
| 拓扑极性表面积 | 202.0 Ų |
| 氢键供体数 | 4 |
| 氢键受体数 | 9 |
| 可旋转键数 | 20 |
| 精确质量 | 762.35974 |
| 重原子数 | 53 |
| 复杂度 | 1110.0 |
化学标识符
| CAS 编号 | 158628-72-9 |
|---|---|
| SMILES | CC(C)CN(CC1=CSC(=N1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O |
| InChIKey | MDMHJYURPHTYGO-SNZVYYTPSA-N |
专利应用标签
基于SureChEMBL全球专利数据库中4个IPC专利分类衍生。
产品概述
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-（CAS 158628-72-9），分子式为C40H54N6O5S2，分子量为762.36 g/mol。IUPAC名：1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[2-methylpropyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate。
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-化学性质概览
属性洞察：2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的XLogP值为7.4，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202.0 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，2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-有4个氢键供体和9个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的CAS号是多少？
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的CAS号为158628-72-9。
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的分子式是什么？
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的分子式为C40H54N6O5S2。
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的分子量是多少？
2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的分子量为762.36 g/mol。
在哪里可以购买2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-？
您可以直接向科弘生物询价2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-。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2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-的定制合成服务？
是的，科弘生物提供2,7,10,12-Tetraazapentadecanoic acid, 4-hydroxy-14-methyl-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-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。