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Home > Pyridines > 121845-46-3
121845-46-3 | Pyrido[3,4-e]-1,2,4-triazine, 3-heptadecyl-
CAS No: 121845-46-3 Catalog No: AG00163W MDL No:
Product Description
Catalog Number:
AG00163W
Chemical Name:
Pyrido[3,4-e]-1,2,4-triazine, 3-heptadecyl-
CAS Number:
121845-46-3
Molecular Formula:
C23H38N4
Molecular Weight:
370.5746
IUPAC Name:
3-heptadecylpyrido[3,4-e][1,2,4]triazine
InChI:
InChI=1S/C23H38N4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-25-22-20-24-19-18-21(22)26-27-23/h18-20H,2-17H2,1H3
InChI Key:
ULGZKTOSEWFLNK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCc1nnc2c(n1)cncc2
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.31g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.585g/mol
Monoisotopic Mass:
370.31g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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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