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219828-99-6 | 1H-Imidazo[4,5-a]pyrrolo[3,4-c]carbazole-4,6(5H,11H)-dione
CAS No: 219828-99-6 Catalog No: AG007OJE MDL No:
Product Description
Catalog Number:
AG007OJE
Chemical Name:
1H-Imidazo[4,5-a]pyrrolo[3,4-c]carbazole-4,6(5H,11H)-dione
CAS Number:
219828-99-6
Molecular Formula:
C15H8N4O2
Molecular Weight:
276.2496
IUPAC Name:
3,5,9,19-tetrazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1,4,6,11,13,15,17-heptaene-8,10-dione
InChI:
InChI=1S/C15H8N4O2/c20-14-9-8-6-3-1-2-4-7(6)18-12(8)13-11(16-5-17-13)10(9)15(21)19-14/h1-5,18H,(H,16,17)(H,19,20,21)
InChI Key:
LBTREMHIJGMYQN-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c2c1c1c3ccccc3[nH]c1c1c2nc[nH]1
Properties
Complexity:
510
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.065g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
276.255g/mol
Monoisotopic Mass:
276.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluation of analogs of the marine alkaloids granulatimide and isogranulatimide. | European journal of medicinal chemistry 20120801 |
| Marine pyrrolocarbazoles and analogues: synthesis and kinase inhibition. | Marine drugs 20091201 |
| Synthesis, checkpoint kinase 1 inhibitory properties and in vitro antiproliferative activities of new pyrrolocarbazoles. | Bioorganic & medicinal chemistry 20080415 |
| Synthesis, in vitro antiproliferative activities, and Chk1 inhibitory properties of pyrrolo[3,4-a]carbazole-1,3-diones, pyrrolo[3,4-c]carbazole-1,3-diones, and 2-aminopyridazino[3,4-a]pyrrolo[3,4-c]carbazole-1,3,4,7-tetraone. | European journal of medicinal chemistry 20080201 |
| Synthesis and biological activities of new checkpoint kinase 1 inhibitors structurally related to granulatimide. | Journal of medicinal chemistry 20070920 |
| Synthesis and biological activities of isogranulatimide analogues. | Bioorganic & medicinal chemistry 20070901 |
| Bis-imide granulatimide analogues as potent Checkpoint 1 kinase inhibitors. | European journal of pharmacology 20070112 |
| Aryl[a]pyrrolo[3,4-c]carbazoles as selective cyclin D1-CDK4 inhibitors. | Bioorganic & medicinal chemistry letters 20031103 |
| Synthesis of granulatimide positional analogues. | Chemical & pharmaceutical bulletin 20030201 |
| New synthetic route to granulatimide and its structural analogues. | Chemical & pharmaceutical bulletin 20020601 |
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