Home Other Building Blocks 6-Phenylphenanthridine-3,8-diamine

6-Phenylphenanthridine-3,8-diamine

CAS No.:
52009-64-0
Catalog Number:
AG0033K5
Molecular Formula:
C19H15N3
Molecular Weight:
285.3425
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Product Description
Catalog Number:
AG0033K5
Chemical Name:
6-Phenylphenanthridine-3,8-diamine
CAS Number:
52009-64-0
Molecular Formula:
C19H15N3
Molecular Weight:
285.3425
MDL Number:
MFCD00075152
IUPAC Name:
6-phenylphenanthridine-3,8-diamine
InChI:
InChI=1S/C19H15N3/c20-13-6-8-15-16-9-7-14(21)11-18(16)22-19(17(15)10-13)12-4-2-1-3-5-12/h1-11H,20-21H2
InChI Key:
CPNAVTYCORRLMH-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)c(nc1c2ccc(c1)N)c1ccccc1
EC Number:
257-602-3
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.127g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
285.35g/mol
Monoisotopic Mass:
285.127g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Influence of long-chain aliphatic dopants on the spectroscopic properties of polyketimine containing 3,8-diamino-6-phenylphenanthridine and ethylene linkage in the main chain. Noncovalent interaction: proton transfer, hydrogen and halogen bonding. The journal of physical chemistry. A 20080821
Synthesis and characterization of polyketanils with 3,8-diamino-6-phenylphenanthridine moieties exhibiting light emitting properties molecular and supramolecular engineering concept. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20080201
The effect of charge on the volume change of DNA binding with intercalator DAPP. The journal of physical chemistry. B 20070405
Binding of cationic and neutral phenanthridine intercalators to a DNA oligomer is controlled by dispersion energy: quantum chemical calculations and molecular mechanics simulations. Chemistry (Weinheim an der Bergstrasse, Germany) 20051216
Synthesis of DNA with phenanthridinium as an artificial DNA base. The Journal of organic chemistry 20040206
The binding of ethidium bromide with DNA: interaction with single- and double-stranded structures. Experimental & molecular medicine 20031231
Properties