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Home > Imidazoles > 122716-22-7
122716-22-7 | 1H-Imidazole, 2-(3,4-dihydro-2-naphthalenyl)-4,5-dihydro-
CAS No: 122716-22-7 Catalog No: AG000J1O MDL No:
Product Description
Catalog Number:
AG000J1O
Chemical Name:
1H-Imidazole, 2-(3,4-dihydro-2-naphthalenyl)-4,5-dihydro-
CAS Number:
122716-22-7
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
IUPAC Name:
2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C13H14N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-4,9H,5-8H2,(H,14,15)
InChI Key:
SXZUZNSWIBDKGQ-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)C1=Cc2c(CC1)cccc2
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| 3-[5-(4,5-dihydro-1H-imidazol-2-yl)-furan-2-yl]phenylamine (Amifuraline), a promising reversible and selective peripheral MAO-A inhibitor. | Journal of medicinal chemistry 20060907 |
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