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Home > Pyridines > 121845-63-4
121845-63-4 | Pyrido[3,4-e]-1,2,4-triazine, 3-(4-ethoxyphenyl)-
CAS No: 121845-63-4 Catalog No: AG00164V MDL No:
Product Description
Catalog Number:
AG00164V
Chemical Name:
Pyrido[3,4-e]-1,2,4-triazine, 3-(4-ethoxyphenyl)-
CAS Number:
121845-63-4
Molecular Formula:
C14H12N4O
Molecular Weight:
252.2713
IUPAC Name:
3-(4-ethoxyphenyl)pyrido[3,4-e][1,2,4]triazine
InChI:
InChI=1S/C14H12N4O/c1-2-19-11-5-3-10(4-6-11)14-16-13-9-15-8-7-12(13)17-18-14/h3-9H,2H2,1H3
InChI Key:
VQLHQAWJTBFBDQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)c1nnc2c(n1)cncc2
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.277g/mol
Monoisotopic Mass:
252.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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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