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Home > Imidazoles > 837376-59-7
837376-59-7 | Pyridine, 3-(1-ethyl-1H-imidazol-4-yl)-
CAS No: 837376-59-7 Catalog No: AG008IBR MDL No:
Product Description
Catalog Number:
AG008IBR
Chemical Name:
Pyridine, 3-(1-ethyl-1H-imidazol-4-yl)-
CAS Number:
837376-59-7
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
IUPAC Name:
3-(1-ethylimidazol-4-yl)pyridine
InChI:
InChI=1S/C10H11N3/c1-2-13-7-10(12-8-13)9-4-3-5-11-6-9/h3-8H,2H2,1H3
InChI Key:
RBKCNBISIDBWKZ-UHFFFAOYSA-N
SMILES:
CCn1cnc(c1)c1cccnc1
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| 5-substituted, 6-substituted, and unsubstituted 3-heteroaromatic pyridine analogues of nicotine as selective inhibitors of cytochrome P-450 2A6. | Journal of medicinal chemistry 20050113 |
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