CAS 2173052-68-9: Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-1-[(2R)-1-oxo-2-[[(1R)-2-oxo-1-(2-phenylethyl)pentyl]amino]propyl]-, (2S,3aS,6aS)-

Description: Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-1-[(2R)-1-oxo-2-[[(1R)-2-oxo-1-(2-phenylethyl)pentyl]amino]propyl]-, (2S,3aS,6aS)- is a complex organic compound characterized by its unique bicyclic structure, which includes a cyclopentane and pyrrole moiety. This compound features multiple functional groups, including a carboxylic acid and amide, contributing to its potential reactivity and biological activity. The stereochemistry indicated by the (2S,3aS,6aS) designation suggests specific spatial arrangements of atoms, which can significantly influence the compound's properties and interactions. It may exhibit solubility in polar solvents due to the presence of the carboxylic acid group, while the hydrophobic phenyl group can impart lipophilicity. Such compounds are often of interest in medicinal chemistry for their potential therapeutic applications, particularly in drug design and development. The presence of multiple chiral centers also suggests that the compound could exist in various stereoisomeric forms, which may have different biological activities.

Formula: C₂₄H₃₄N₂O₄

InChI: InChI=1S/C24H34N2O4/c1-3-8-22(27)19(14-13-17-9-5-4-6-10-17)25-16(2)23(28)26-20-12-7-11-18(20)15-21(26)24(29)30/h4-6,9-10,16,18-21,25H,3,7-8,11-15H2,1-2H3,(H,29,30)/t16-,18+,19-,20+,21+/m1/s1

InChI key: InChIKey=UJRWOTKNFKYDQM-VLQCVTHLSA-N

SMILES: O=C(O)C1N(C(=O)C(NC(C(=O)CCC)CCC=2C=CC=CC2)C)C3CCCC3C1

Synonyms:

• Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-1-[(2R)-1-oxo-2-[[(1R)-2-oxo-1-(2-phenylethyl)pentyl]amino]propyl]-, (2S,3aS,6aS)-

1-{N-[2-Oxo-1-(2-phenylethyl)pentyl]-D-alanyl}octahydrocyclopenta[b]pyrrole-2-carboxylic acid

CAS: 2173052-68-9

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• Formula: C₂₄H₃₄N₂O₄
• Purity: Min. 95%
• Molecular weight: 414.54 g/mol