(8S)-8-Ethyl-2,3-dihydro-8-hydroxy-15-((4-methyl-1-piperazinyl)methyl)-11H-1,4-Dioxino(2,3-g)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-9,12(8H,14H)-dione
[CAS# 149882-10-0]

Identification

• Name: (8S)-8-Ethyl-2,3-dihydro-8-hydroxy-15-((4-methyl-1-piperazinyl)methyl)-11H-1,4-Dioxino(2,3-g)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-9,12(8H,14H)-dione
• Synonyms: Gi-147211C; Gw-211; Nx-211
• Molecular Formula: C₂₈H₃₀N₄O₆
• Molecular Weight: 518.57
• CAS Registry Number: 149882-10-0
• SMILES: [C@@]7(C2=C(C(N1CC5=C(C1=C2)N=C4C=C3OCCOC3=CC4=C5CN6CCN(C)CC6)=O)COC7=O)(CC)O
• InChI: 1S/C28H30N4O6/c1-3-28(35)20-11-22-25-18(14-32(22)26(33)19(20)15-38-27(28)34)17(13-31-6-4-30(2)5-7-31)16-10-23-24(12-21(16)29-25)37-9-8-36-23/h10-12,35H,3-9,13-15H2,1-2H3/t28-/m0/s1
• InChIKey: RVFGKBWWUQOIOU-NDEPHWFRSA-N

Properties

• Density: 1.504g/cm³ (Cal.)
• Boiling point: 844.789°C at 760 mmHg (Cal.)
• Flash point: 464.712°C (Cal.)

References

• (1): Renner et al.. Bioactivity-Guided Mapping and Navigation of Chemical Space, Nature Chemical Biology, 2009