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20308-98-9 | Pyridine, 4-(9-anthracenyl)-
CAS No: 20308-98-9 Catalog No: AG0028NW MDL No:
Product Description
Catalog Number:
AG0028NW
Chemical Name:
Pyridine, 4-(9-anthracenyl)-
CAS Number:
20308-98-9
Molecular Formula:
C19H13N
Molecular Weight:
255.3132
IUPAC Name:
4-anthracen-9-ylpyridine
InChI:
InChI=1S/C19H13N/c1-3-7-17-15(5-1)13-16-6-2-4-8-18(16)19(17)14-9-11-20-12-10-14/h1-13H
InChI Key:
YBUFEUDZXKMCFS-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1c2ccccc2cc2c1cccc2
NSC Number:
99471
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.32g/mol
Monoisotopic Mass:
255.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Pharmacophore-based discovery of substituted pyridines as novel dopamine transporter inhibitors. | Bioorganic & medicinal chemistry letters 20030210 |
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