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Home > Pyridines > 121845-75-8
121845-75-8 | Pyrido[3,4-e]-1,2,4-triazine, 5-methyl-3-(4-pyridinyl)-
CAS No: 121845-75-8 Catalog No: AG00164M MDL No:
Product Description
Catalog Number:
AG00164M
Chemical Name:
Pyrido[3,4-e]-1,2,4-triazine, 5-methyl-3-(4-pyridinyl)-
CAS Number:
121845-75-8
Molecular Formula:
C12H9N5
Molecular Weight:
223.2334
IUPAC Name:
5-methyl-3-pyridin-4-ylpyrido[3,4-e][1,2,4]triazine
InChI:
InChI=1S/C12H9N5/c1-8-11-10(4-7-14-8)16-17-12(15-11)9-2-5-13-6-3-9/h2-7H,1H3
InChI Key:
JJBUKSHWPOGRFY-UHFFFAOYSA-N
SMILES:
Cc1nccc2c1nc(nn2)c1ccncc1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.086g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.239g/mol
Monoisotopic Mass:
223.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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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