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254114-34-6

254114-34-6 | 7H-Indolo[3,2-j]phenanthridine-7,13(12H)-dione

CAS No: 254114-34-6 Catalog No: AG006UVI MDL No:

Product Description

Catalog Number:
AG006UVI
Chemical Name:
7H-Indolo[3,2-j]phenanthridine-7,13(12H)-dione
CAS Number:
254114-34-6
Molecular Formula:
C19H10N2O2
Molecular Weight:
298.2949
IUPAC Name:
10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione
InChI:
InChI=1S/C19H10N2O2/c22-18-12-9-20-13-7-3-1-5-10(13)15(12)19(23)17-16(18)11-6-2-4-8-14(11)21-17/h1-9,21H
InChI Key:
CCPDIHKLISWESE-UHFFFAOYSA-N
SMILES:
O=C1c2c3ccccc3ncc2C(=O)c2c1[nH]c1c2cccc1

Properties

Complexity:
534  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.074g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
298.301g/mol
Monoisotopic Mass:
298.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

Literature

Title Journal
Synthesis and antimalarial activity of calothrixins A and B, and their N-alkyl derivatives. Bioorganic & medicinal chemistry letters 20120715
Concise total synthesis of calothrixins A and B. Organic letters 20110701
Calothrixins, a new class of human DNA topoisomerase I poisons. Journal of natural products 20090327
Structure-activity delineation of quinones related to the biologically active Calothrixin B. Bioorganic & medicinal chemistry letters 20070101
Concise and efficient synthesis of calothrixin B. The Journal of organic chemistry 20061027
A new radical-based route to calothrixin B. Organic letters 20060216
Synthesis, electrochemistry, and bioactivity of the cyanobacterial calothrixins and related quinones. Journal of medicinal chemistry 20040923
Friedel-Crafts acylation and metalation strategies in the synthesis of calothrixins A and B. The Journal of organic chemistry 20031114

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