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CAS 74874-09-2

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Ethyl (2R,4R)-1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylate

Description:
Ethyl (2R,4R)-1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylate, with CAS number 74874-09-2, is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups such as piperidine, sulfonamide, and imino groups. This compound is notable for its potential biological activity, particularly in medicinal chemistry, where it may serve as a lead compound for the development of pharmaceuticals. The presence of a quinoline moiety suggests possible interactions with biological targets, making it of interest in drug discovery. Its stereochemistry, indicated by the (2R,4R) and (2S) designations, implies specific spatial arrangements that can significantly influence its biological properties and interactions. Additionally, the ethyl ester functional group may enhance its solubility and bioavailability. Overall, this compound exemplifies the complexity often found in drug-like molecules, combining various chemical functionalities that can contribute to its pharmacological profile.
Formula:C25H35N7O7S
InChI:InChI=1S/C25H35N7O7S/c1-4-39-24(34)20-14-16(2)10-12-31(20)23(33)19(8-6-11-27-25(26)29-32(35)36)30-40(37,38)21-9-5-7-18-13-17(3)15-28-22(18)21/h5,7,9,13,15-16,19-20,30H,4,6,8,10-12,14H2,1-3H3,(H3,26,27,29)/t16-,19+,20-/m1/s1
InChI key:InChIKey=DWOYDKNIEZWRDH-LSTHTHJFSA-N
SMILES:S(N[C@H](C(=O)N1[C@@H](C(OCC)=O)C[C@H](C)CC1)CCCNC(NN(=O)=O)=N)(=O)(=O)C=2C3=C(C=CC2)C=C(C)C=N3
Synonyms:
  • 2-Piperidinecarboxylic Acid, 1-[5-[Imino(Nitroamino)Methyl]Amino]-2-[[(3-Methyl-8-Quinolinyl)Sulfonyl]Amino]-1-Oxopentyl]-4-Methyl-,Ethyl Ester,[2R-[1(S*), 2Alpha, 4Beta]]-
  • 2-Piperidinecarboxylic acid, 1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, (2R,4R)-
  • 2-Piperidinecarboxylic acid, 1-[5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, [2R-[1(S*),2α,4β]]-
  • Ethyl (2R,4R)-1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylate
  • Ethyl 1-[5-[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylic acid
  • [2R-[1(S*),2α,4β]]-1-[5-[[imino(nitroamino)methyl]-amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-Piperidinecarboxylic acid ethyl ester
  • ethyl (2R,4R)-1-{(E)-N~5~-[amino(nitroamino)methylidene]-N~2~-[(3-methylquinolin-8-yl)sulfonyl]-L-ornithyl}-4-methylpiperidine-2-carboxylate
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