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Home > Pyridines > 121845-79-2
121845-79-2 | Pyrido[3,4-e]-1,2,4-triazine, 5,7-dimethyl-3-(4-pyridinyl)-
CAS No: 121845-79-2 Catalog No: AG00164J MDL No:
Product Description
Catalog Number:
AG00164J
Chemical Name:
Pyrido[3,4-e]-1,2,4-triazine, 5,7-dimethyl-3-(4-pyridinyl)-
CAS Number:
121845-79-2
Molecular Formula:
C13H11N5
Molecular Weight:
237.2599
IUPAC Name:
5,7-dimethyl-3-pyridin-4-ylpyrido[3,4-e][1,2,4]triazine
InChI:
InChI=1S/C13H11N5/c1-8-7-11-12(9(2)15-8)16-13(18-17-11)10-3-5-14-6-4-10/h3-7H,1-2H3
InChI Key:
ZKIOMLWEPUHBCQ-UHFFFAOYSA-N
SMILES:
Cc1cc2nnc(nc2c(n1)C)c1ccncc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.101g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.266g/mol
Monoisotopic Mass:
237.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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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