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121845-56-5

121845-56-5 | Pyrido[3,4-e]-1,2,4-triazine, 3-(2,4-difluorophenyl)-

CAS No: 121845-56-5 Catalog No: AG001651 MDL No:

Product Description

Catalog Number:
AG001651
Chemical Name:
Pyrido[3,4-e]-1,2,4-triazine, 3-(2,4-difluorophenyl)-
CAS Number:
121845-56-5
Molecular Formula:
C12H6F2N4
Molecular Weight:
244.1996
IUPAC Name:
3-(2,4-difluorophenyl)pyrido[3,4-e][1,2,4]triazine
InChI:
InChI=1S/C12H6F2N4/c13-7-1-2-8(9(14)5-7)12-16-11-6-15-4-3-10(11)17-18-12/h1-6H
InChI Key:
JBXAMVYCHBTMQQ-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)c1nnc2c(n1)cncc2

Properties

Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.056g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.205g/mol
Monoisotopic Mass:
244.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
Pyrido[3,4-e]-1,2,4-triazines and related heterocycles as potential antifungal agents. Journal of medicinal chemistry 19891101

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