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CAS 1071992-61-4

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(5S,8S,10aR)-N-(Diphenylmethyl)decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-6-oxo-3-(2-phenylacetyl)pyrrolo[1,2-a][1,5]diazocine-8-carboxamide

Description:
The chemical substance with the name "(5S,8S,10aR)-N-(Diphenylmethyl)decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-6-oxo-3-(2-phenylacetyl)pyrrolo[1,2-a][1,5]diazocine-8-carboxamide" and CAS number "1071992-61-4" is a complex organic compound characterized by its multi-ring structure and various functional groups. It features a pyrrolo[1,2-a][1,5]diazocine core, which contributes to its unique chemical properties and potential biological activity. The presence of multiple chiral centers indicates that the compound may exhibit stereoisomerism, which can influence its pharmacological effects. The molecule contains amine, ketone, and carboxamide functional groups, suggesting potential interactions with biological targets. Its diphenylmethyl substituent may enhance lipophilicity, potentially affecting its solubility and permeability. Overall, this compound is of interest in medicinal chemistry, particularly for its potential therapeutic applications, although specific biological activities and mechanisms would require further investigation through experimental studies.
Formula:C35H41N5O4
InChI:InChI=1S/C35H41N5O4/c1-24(36-2)33(42)37-29-23-39(31(41)22-25-12-6-3-7-13-25)21-20-28-18-19-30(40(28)35(29)44)34(43)38-32(26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17,24,28-30,32,36H,18-23H2,1-2H3,(H,37,42)(H,38,43)/t24-,28+,29-,30-/m0/s1
InChI key:InChIKey=YBYZHVZWINISJO-XPSCAIQQSA-N
SMILES:C(NC(C1=CC=CC=C1)C2=CC=CC=C2)(=O)[C@H]3N4[C@](CC3)(CCN(C(CC5=CC=CC=C5)=O)C[C@H](NC([C@@H](NC)C)=O)C4=O)[H]
Synonyms:
  • (5S,8S,10aR)-N-(Diphenylmethyl)decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-6-oxo-3-(2-phenylacetyl)pyrrolo[1,2-a][1,5]diazocine-8-carboxamide
  • SM 337
  • Pyrrolo[1,2-a][1,5]diazocine-8-carboxamide, N-(diphenylmethyl)decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-6-oxo-3-(2-phenylacetyl)-, (5S,8S,10aR)-
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