Description

(S)-2-(3-((2-isopropylthiazol-4-yl)methyl)-3-methylureido)-4-morpholinobutanoic acid (CAS No. 1004316-92-0) is a high-purity synthetic organic compound with the molecular formula C₁₇H₂₈N₄O₄S. This specialized chemical features a unique thiazole and morpholine backbone, making it a valuable intermediate for pharmaceutical and biochemical research. Its IUPAC name, (2S)-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]-4-morpholin-4-ylbutanoic acid, reflects its complex stereochemistry and functional groups. Suitable for use in drug discovery, medicinal chemistry, and enzyme inhibition studies, this compound is rigorously tested for quality and consistency. Available in milligram to gram quantities, it is ideal for researchers requiring precise and reliable building blocks for novel therapeutic agents.

Properties

• CAS Number: 1004316-92-0
• Complexity: 474
• IUPAC Name: (2S)-2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-4-morpholino-butanoic acid
• InChI: InChI=1S/C17H28N4O4S/c1-12(2)15-18-13(11-26-15)10-20(3)17(24)19-14(16(22)23)4-5-21-6-8-25-9-7-21/h11-12,14H,4-10H2,1-3H3,(H,19,24)(H,22,23)/t14-/m0/s1
• InChI Key: QEYXFSIVDPCIQM-AWEZNQCLSA-N
• Exact Mass: 384.18312656
• Molecular Formula: C17H28N4O4S
• Molecular Weight: 384.5
• SMILES: CC(C)C1=NC(=CS1)CN(C)C(=O)N[C@@H](CCN2CCOCC2)C(=O)O
• Topological: 123
• Monoisotopic Mass: 384.18312656
• Synonyms: 1004316-92-0, (S)-2-(3-((2-isopropylthiazol-4-yl)methyl)-3-methylureido)-4-morpholinobutanoic acid, PY42QR6P7C, UNII-PY42QR6P7C, (2S)-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]-4-morpholin-4-ylbutanoic acid, (2S)-2-((Methyl(((2-(propan-2-yl)-1,3-thiazol-4-yl)methyl))carbamoyl)amino)-4-(morpholin-4-yl)butanoic acid, (alphaS)-alpha-[[[Methyl[[2-(1-methylethyl)-4-thiazolyl]methyl]amino]carbonyl]amino]-4-morpholinebutanoic acid, (2S)-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}-4-(morpholin-4-yl)butanoic acid, 4-Morpholinebutanoic acid, alpha-(((methyl((2-(1-methylethyl)-4-thiazolyl)methyl)amino)carbonyl)amino)-, (alphaS)-, 4-Morpholinebutanoic acid, alpha-[[[methyl[[2-(1-methylethyl)-4-thiazolyl]methyl]amino]carbonyl]amino]-, (alphaS)-, SCHEMBL2736233, AC-28962, DB-247742, 4-MORPHOLINEBUTANOIC ACID, .ALPHA.-(((METHYL((2-(1-METHYLETHYL)-4-THIAZOLYL)METHYL)AMINO)CARBONYL)AMINO)-, (.ALPHA.S)-

Application

This compound is primarily utilized as a key intermediate in the synthesis of biologically active molecules, particularly in the development of enzyme inhibitors and receptor modulators. Its structural features, including the thiazole and morpholine moieties, make it valuable for targeting specific protein interactions in medicinal chemistry. Researchers may employ it in the design of novel therapeutics for metabolic or neurological disorders. Additionally, it serves as a scaffold for probing structure-activity relationships (SAR) in drug discovery pipelines.

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