CAS 877674-77-6

(2Z)-7-Chloro-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-2-heptenoic acid

Description:

(2Z)-7-Chloro-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-2-heptenoic acid is a synthetic organic compound characterized by its unique structural features, including a heptenoic acid backbone with a double bond and a chlorine substituent at the seventh carbon. The presence of a dimethylcyclopropyl group contributes to its steric properties, while the carbonyl and amino functionalities suggest potential for hydrogen bonding and reactivity in various chemical environments. This compound is likely to exhibit moderate solubility in organic solvents due to its hydrophobic cyclopropyl moiety, while the carboxylic acid group may impart some polar characteristics. Its stereochemistry, indicated by the (1S) and (2Z) designations, plays a crucial role in its biological activity and interaction with biological targets. Such compounds are often studied for their potential pharmaceutical applications, particularly in the development of novel therapeutic agents. Overall, the unique combination of functional groups and stereochemistry makes this compound of interest in medicinal chemistry and drug design.

Formula: C₁₃H₂₀ClNO₃

InChI: InChI=1S/C13H20ClNO3/c1-13(2)8-9(13)11(16)15-10(12(17)18)6-4-3-5-7-14/h6,9H,3-5,7-8H2,1-2H3,(H,15,16)(H,17,18)/b10-6-/t9-/m1/s1

InChI key: InChIKey=OTSSACCOAAGLRY-WPVMNKCKSA-N

SMILES: C(N/C(=C\CCCCCl)/C(O)=O)(=O)[C@@H]1C(C)(C)C1

Synonyms:

• (2Z)-7-Chloro-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-2-heptenoic acid
• (Z)-(S)-7-chloro-2-(2,2-dimethylcyclopropanecarboxamido)-2-heptenoic acid
• 2-Heptenoic acid, 7-chloro-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-, (2Z)-
• 7-Chloro-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-2-heptenoic acid
• Cdcha

Cilastatin Impurity 1

CAS: 877674-77-6

Formula: C₁₃H₂₀ClNO₃

Molecular weight: 273.76

Ref: 4Z-C-136012

(2Z)​-7-​Chloro-​2-​[[[(1S)​-​2,​2-​dimethylcyclopropyl]​carbonyl]​amino]​-​2-​heptenoic Acid

Controlled Product

CAS: 877674-77-6

Stability Hygroscopic
Applications (2Z)​-7-​Chloro-​2-​[[[(1S)​-​2,​2-​dimethylcyclopropyl]​carbonyl]​amino]​-​2-​heptenoic Acid is a reagent used in the preparation of Cilastatin (C441105), prevents renal metabolism of penem and carbapenem antibiotics by specific and reversible dehydropeptidase I inhibition. Antibacterial adjunct.
References Finlay, K.R., et al.: Invest. Ophthalmol. Visual Sci., 24, 1147 (1983), Norrby, S.R., et al.: Antimicrob. Agents Chemother., 23, 300 (1983), Washburn, D.E., et al.: J. Antimicrob. Chemother., 12, 39 (1983),

Formula: C₁₃H₂₀ClNO₃

Color and Shape: Neat

Molecular weight: 273.76

Ref: TR-C368515

Cilastatin Impurity 1

CAS: 877674-77-6

Formula: C₁₃H₂₀ClNO₃

Molecular weight: 273.8

Ref: ST-EA-CP-C72007