2631659-57-7

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2631659-57-7 Structure

Identification	Back Directory
[Name] 2H-Pyrazino[1′,2′:1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-dione, 6,10b,11,11a-tetrahydro-3-(1H-indol-3-ylmethyl)-6,10b-bis(phenylmethyl)-, (3S,5aS,10bS,11aS)-
[CAS] 2631659-57-7
[Synonyms] 2H-Pyrazino[1′,2′:1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-dione, 6,10b,11,11a-tetrahydro-3-(1H-indol-3-ylmethyl)-6,10b-bis(phenylmethyl)-, (3S,5aS,10bS,11aS)-
[Molecular Formula] C36H32N4O2
[MOL File] 2631659-57-7.mol
[Molecular Weight] 552.67

Chemical Properties	Back Directory
[Boiling point ] 839.8±65.0 °C(predicted)
[density ] 1.37±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[pka] 13.48±0.60(predicted)

Hazard Information	Back Directory
[Uses] C3N-Dbn-Trp2 is an inhibitor for ATP-binding cassette transporter ABCB1. C3N-Dbn-Trp2 inhibits the ABCB1-mediated Rhodamine 123 (HY-D0816) efflux in cells HEK293T and HCT-15 with IC50 of 5.9 μM and 2.2 μM. C3N-Dbn-Trp2 inhibits the Doxorubicin (HY-15142A) efflux, enhances the cytotoxicity of Doxorubicin in ABCB1-expressing cells[1].
[References] [1] Koh JYP, et al., Exploring bat-inspired cyclic tryptophan diketopiperazines as ABCB1 Inhibitors. Commun Chem. 2024 Jul 13;7(1):158. DOI:10.1038/s42004-024-01225-z

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