[5-([1,3]Dioxolo[4,5-f]isoquinolin-8-yl)-1,3-benzodioxol-4-yl]methanol | CAS No. 164991-68-8

[5-([1,3]Dioxolo[4,5-f]isoquinolin-8-yl)-1,3-benzodioxol-4-yl]methanol

Basic Information

CAS Number

164991-68-8

Molecular Formula

C18H13NO5

Molecular Weight

323.3 g/mol

AD

Basic Physical Properties

Melting Point

226-227 ºC

C1OC2=C(O1)C3=CC(=NC=C3C=C2)C4=C(C5=C(C=C4)OCO5)CO

InChI

InChI=1S/C18H13NO5/c20-7-13-11(2-4-16-18(13)24-9-22-16)14-5-12-10(6-19-14)1-3-15-17(12)23-8-21-15/h1-6,20H,7-9H2

InChIKey

GKOMWDNIMJHCDB-UHFFFAOYSA-N

LogP

2.8515000000000015

Topological Polar Surface Area

70.04000000000002 Ų

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

463

Synonyms & References

English

  • [5-([1,3]dioxolo[4,5-f]isoquinolin-8-yl)-1,3-benzodioxol-4-yl]methanol
  • DTXSID501166636
  • CHEMBL5188964
  • 5-(1,3-Dioxolo[4,5-f]isoquinolin-8-yl)-1,3-benzodioxole-4-methanol
  • 164991-68-8
  • (5-([1,3]Dioxolo[4,5-f]isoquinolin-8-yl)benzo[d][1,3]dioxol-4-yl)methanol
  • Decumbenine B
  • 1,3-Benzodioxole-4-methanol,5-(1,3-dioxolo[4,5-f]isoquinolin-8-yl)-
  • DECUMBENINE B

MDL Number

MFCD28335324

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