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25920-18-7 | Pyridine, 2,4-bis(phenylmethyl)-
CAS No: 25920-18-7 Catalog No: AG002R21 MDL No:
Product Description
Catalog Number:
AG002R21
Chemical Name:
Pyridine, 2,4-bis(phenylmethyl)-
CAS Number:
25920-18-7
Molecular Formula:
C19H17N
Molecular Weight:
259.3450
IUPAC Name:
2,4-dibenzylpyridine
InChI:
InChI=1S/C19H17N/c1-3-7-16(8-4-1)13-18-11-12-20-19(15-18)14-17-9-5-2-6-10-17/h1-12,15H,13-14H2
InChI Key:
FXGBAEGZOCVPCU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1ccnc(c1)Cc1ccccc1
EC Number:
247-347-6
NSC Number:
77134
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.136g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.352g/mol
Monoisotopic Mass:
259.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
Literature
| Title | Journal |
|---|---|
| Pharmacophore-based discovery of substituted pyridines as novel dopamine transporter inhibitors. | Bioorganic & medicinal chemistry letters 20030210 |
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